N,N-dimethyl-3-naphthalen-1-yloxy-1-phenyl-propan-1-amine; 4-methylbenzenesulfonic acid

Systemtic Name: N,N-dimethyl-3-naphthalen-1-yloxy-1-phenyl-propan-1-amine; 4-methylbenzenesulfonic acid Openeye Name: N,N-dimethyl-3-(1-naphthyloxy)-1-phenyl-propan-1-amine; 4-methylbenzenesulfonic acid CAS Name: N,N-dimethyl-3-(1-naphthalenyloxy)-1-phenyl-1-propanamine; 4-methylbenzenesulfonic acid IUPAC Name: N,N-dimethyl-3-naphthalen-1-yloxy-1-phenylpropan-1-amine; 4-methylbenzenesulfonic acid Traditional Name: dimethyl-[3-(1-naphthoxy)-1-phenyl-propyl]amine; tosylic acid Formula: C28H31NO4S MolecularWeight: 477.61504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.CN(C)C(CCOC1=CC=CC2=CC=CC=C21)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.CN(C)C(CCOC1=CC=CC2=CC=CC=C21)C3=CC=CC=C3

InChI

InChI=1S/C21H23NO.C7H8O3S/c1-22(2)20(18-10-4-3-5-11-18)15-16-23-21-14-8-12-17-9-6-7-13-19(17)21;1-6-2-4-7(5-3-6)11(8,9)10/h3-14,20H,15-16H2,1-2H3;2-5H,1H3,(H,8,9,10)