(3S)-4-[2-(4-methoxyphenyl)ethylamino]-3-(naphthalen-2-ylsulfonylamino)-4-oxidanylidene-butanoic acid

Systemtic Name: (3S)-4-[2-(4-methoxyphenyl)ethylamino]-3-(naphthalen-2-ylsulfonylamino)-4-oxidanylidene-butanoic acid Openeye Name: (3S)-4-[2-(4-methoxyphenyl)ethylamino]-3-(2-naphthylsulfonylamino)-4-oxo-butanoic acid CAS Name: (3S)-4-[2-(4-methoxyphenyl)ethylamino]-3-(2-naphthalenylsulfonylamino)-4-oxobutanoic acid IUPAC Name: (3S)-4-[2-(4-methoxyphenyl)ethylamino]-3-(naphthalen-2-ylsulfonylamino)-4-oxobutanoic acid Traditional Name: (3S)-4-keto-4-[2-(4-methoxyphenyl)ethylamino]-3-(2-naphthylsulfonylamino)butyric acid Formula: C23H24N2O6S MolecularWeight: 456.51146

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=O)C(CC(=O)O)NS(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=O)[C@H](CC(=O)O)NS(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C23H24N2O6S/c1-31-19-9-6-16(7-10-19)12-13-24-23(28)21(15-22(26)27)25-32(29,30)20-11-8-17-4-2-3-5-18(17)14-20/h2-11,14,21,25H,12-13,15H2,1H3,(H,24,28)(H,26,27)/t21-/m0/s1