(E)-but-2-enedioic acid; 3-cycloheptyl-N,N-dimethyl-3-naphthalen-1-yloxy-propan-1-amine; 3-(6-iodanylnaphthalen-1-yl)oxy-N-methyl-3-pyridin-4-yl-propan-1-amine; methanoic acid

Systemtic Name: (E)-but-2-enedioic acid; 3-cycloheptyl-N,N-dimethyl-3-naphthalen-1-yloxy-propan-1-amine; 3-(6-iodanylnaphthalen-1-yl)oxy-N-methyl-3-pyridin-4-yl-propan-1-amine; methanoic acid Openeye Name: 3-cycloheptyl-N,N-dimethyl-3-(1-naphthyloxy)propan-1-amine; formic acid; fumaric acid; 3-[(6-iodo-1-naphthyl)oxy]-N-methyl-3-(4-pyridyl)propan-1-amine CAS Name: (E)-2-butenedioic acid; 3-cycloheptyl-N,N-dimethyl-3-(1-naphthalenyloxy)-1-propanamine; formic acid; 3-[(6-iodo-1-naphthalenyl)oxy]-N-methyl-3-pyridin-4-yl-1-propanamine IUPAC Name: (E)-but-2-enedioic acid; 3-cycloheptyl-N,N-dimethyl-3-naphthalen-1-yloxypropan-1-amine; formic acid; 3-(6-iodonaphthalen-1-yl)oxy-N-methyl-3-pyridin-4-ylpropan-1-amine Traditional Name: [3-cycloheptyl-3-(1-naphthoxy)propyl]-dimethyl-amine; formic acid; fumaric acid; [3-(6-iodo-1-naphthoxy)-3-(4-pyridyl)propyl]-methyl-amine Formula: C46H56IN3O8 MolecularWeight: 905.85661

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Descriptors Computed from Structure

Canonical SMILES:

CNCCC(C1=CC=NC=C1)OC2=CC=CC3=C2C=CC(=C3)I.CN(C)CCC(C1CCCCCC1)OC2=CC=CC3=CC=CC=C32.C(=CC(=O)O)C(=O)O.C(=O)O

Isomeric SMILES

CNCCC(C1=CC=NC=C1)OC2=CC=CC3=C2C=CC(=C3)I.CN(C)CCC(C1CCCCCC1)OC2=CC=CC3=CC=CC=C32.C(=C/C(=O)O)\C(=O)O.C(=O)O

InChI

InChI=1S/C22H31NO.C19H19IN2O.C4H4O4.CH2O2/c1-23(2)17-16-21(19-11-5-3-4-6-12-19)24-22-15-9-13-18-10-7-8-14-20(18)22;1-21-10-9-18(14-7-11-22-12-8-14)23-19-4-2-3-15-13-16(20)5-6-17(15)19;5-3(6)1-2-4(7)8;2-1-3/h7-10,13-15,19,21H,3-6,11-12,16-17H2,1-2H3;2-8,11-13,18,21H,9-10H2,1H3;1-2H,(H,5,6)(H,7,8);1H,(H,2,3)/b;;2-1+;