[4-[(2,4-dimethoxyphenyl)carbonylamino]-3-naphthalen-1-yl-butyl] methanesulfonate

Systemtic Name: [4-[(2,4-dimethoxyphenyl)carbonylamino]-3-naphthalen-1-yl-butyl] methanesulfonate Openeye Name: [4-[(2,4-dimethoxybenzoyl)amino]-3-(1-naphthyl)butyl] methanesulfonate CAS Name: methanesulfonic acid [4-[[(2,4-dimethoxyphenyl)-oxomethyl]amino]-3-(1-naphthalenyl)butyl] ester IUPAC Name: [4-[(2,4-dimethoxybenzoyl)amino]-3-naphthalen-1-ylbutyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[(2,4-dimethoxybenzoyl)amino]-3-(1-naphthyl)butyl] ester Formula: C24H27NO6S MolecularWeight: 457.53928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)NCC(CCOS(=O)(=O)C)C2=CC=CC3=CC=CC=C32)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)NCC(CCOS(=O)(=O)C)C2=CC=CC3=CC=CC=C32)OC

InChI

InChI=1S/C24H27NO6S/c1-29-19-11-12-22(23(15-19)30-2)24(26)25-16-18(13-14-31-32(3,27)28)21-10-6-8-17-7-4-5-9-20(17)21/h4-12,15,18H,13-14,16H2,1-3H3,(H,25,26)