3-azanyl-4-[(2-naphthalen-2-ylsulfonyl-3-phenyl-propanoyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-azanyl-4-[(2-naphthalen-2-ylsulfonyl-3-phenyl-propanoyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 3-amino-4-[[2-(2-naphthylsulfonyl)-3-phenyl-propanoyl]amino]-4-oxo-butanoic acid CAS Name: 3-amino-4-[[2-(2-naphthalenylsulfonyl)-1-oxo-3-phenylpropyl]amino]-4-oxobutanoic acid IUPAC Name: 3-amino-4-[(2-naphthalen-2-ylsulfonyl-3-phenylpropanoyl)amino]-4-oxobutanoic acid Traditional Name: 3-amino-4-keto-4-[[2-(2-naphthylsulfonyl)-3-phenyl-propanoyl]amino]butyric acid Formula: C23H22N2O6S MolecularWeight: 454.49558

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC(=O)C(CC(=O)O)N)S(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)NC(=O)C(CC(=O)O)N)S(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C23H22N2O6S/c24-19(14-21(26)27)22(28)25-23(29)20(12-15-6-2-1-3-7-15)32(30,31)18-11-10-16-8-4-5-9-17(16)13-18/h1-11,13,19-20H,12,14,24H2,(H,26,27)(H,25,28,29)