[3-(4-methylphenyl)carbonyloxy-6-[2-[(phenylmethyl)amino]ethyl]naphthalen-2-yl] 4-methylbenzoate

Systemtic Name: [3-(4-methylphenyl)carbonyloxy-6-[2-[(phenylmethyl)amino]ethyl]naphthalen-2-yl] 4-methylbenzoate Openeye Name: [6-[2-(benzylamino)ethyl]-3-(4-methylbenzoyl)oxy-2-naphthyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [3-[(4-methylphenyl)-oxomethoxy]-6-[2-[(phenylmethyl)amino]ethyl]-2-naphthalenyl] ester IUPAC Name: [6-[2-(benzylamino)ethyl]-3-(4-methylbenzoyl)oxynaphthalen-2-yl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [6-[2-(benzylamino)ethyl]-3-p-toluoyloxy-2-naphthyl] ester Formula: C35H31NO4 MolecularWeight: 529.62494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=C(C=C3C=C(C=CC3=C2)CCNCC4=CC=CC=C4)OC(=O)C5=CC=C(C=C5)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=C(C=C3C=C(C=CC3=C2)CCNCC4=CC=CC=C4)OC(=O)C5=CC=C(C=C5)C

InChI

InChI=1S/C35H31NO4/c1-24-8-13-28(14-9-24)34(37)39-32-21-30-17-12-26(18-19-36-23-27-6-4-3-5-7-27)20-31(30)22-33(32)40-35(38)29-15-10-25(2)11-16-29/h3-17,20-22,36H,18-19,23H2,1-2H3