(E)-but-2-enedioic acid; 1-naphthalen-2-yl-N-propyl-pentan-2-amine

Systemtic Name: (E)-but-2-enedioic acid; 1-naphthalen-2-yl-N-propyl-pentan-2-amine Openeye Name: fumaric acid; 1-(2-naphthyl)-N-propyl-pentan-2-amine CAS Name: (E)-2-butenedioic acid; 1-(2-naphthalenyl)-N-propyl-2-pentanamine IUPAC Name: (E)-but-2-enedioic acid; 1-naphthalen-2-yl-N-propylpentan-2-amine Traditional Name: fumaric acid; 1-(2-naphthylmethyl)butyl-propyl-amine Formula: C22H29NO4 MolecularWeight: 371.46996

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC1=CC2=CC=CC=C2C=C1)NCCC.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCCC(CC1=CC2=CC=CC=C2C=C1)NCCC.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C18H25N.C4H4O4/c1-3-7-18(19-12-4-2)14-15-10-11-16-8-5-6-9-17(16)13-15;5-3(6)1-2-4(7)8/h5-6,8-11,13,18-19H,3-4,7,12,14H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+