[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] 3-[(3,5-dimethylphenyl)-naphthalen-2-ylsulfonyl-amino]propanoate

Systemtic Name: [2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] 3-[(3,5-dimethylphenyl)-naphthalen-2-ylsulfonyl-amino]propanoate Openeye Name: [2-(4-methoxyphenyl)-2-oxo-ethyl] 3-[3,5-dimethyl-N-(2-naphthylsulfonyl)anilino]propanoate CAS Name: 3-[3,5-dimethyl-N-(2-naphthalenylsulfonyl)anilino]propanoic acid [2-(4-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methoxyphenyl)-2-oxoethyl] 3-(3,5-dimethyl-N-naphthalen-2-ylsulfonylanilino)propanoate Traditional Name: 3-[3,5-dimethyl-N-(2-naphthylsulfonyl)anilino]propionic acid [2-keto-2-(4-methoxyphenyl)ethyl] ester Formula: C30H29NO6S MolecularWeight: 531.61936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N(CCC(=O)OCC(=O)C2=CC=C(C=C2)OC)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)C

Isomeric SMILES

CC1=CC(=CC(=C1)N(CCC(=O)OCC(=O)C2=CC=C(C=C2)OC)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)C

InChI

InChI=1S/C30H29NO6S/c1-21-16-22(2)18-26(17-21)31(38(34,35)28-13-10-23-6-4-5-7-25(23)19-28)15-14-30(33)37-20-29(32)24-8-11-27(36-3)12-9-24/h4-13,16-19H,14-15,20H2,1-3H3