(3S)-3-[[9,10-bis(oxidanylidene)anthracen-1-yl]sulfonylamino]-3-phenyl-propanoic acid

Systemtic Name: (3S)-3-[[9,10-bis(oxidanylidene)anthracen-1-yl]sulfonylamino]-3-phenyl-propanoic acid Openeye Name: (3S)-3-[(9,10-dioxo-1-anthryl)sulfonylamino]-3-phenyl-propanoic acid CAS Name: (3S)-3-[(9,10-dioxo-1-anthracenyl)sulfonylamino]-3-phenylpropanoic acid IUPAC Name: (3S)-3-[(9,10-dioxoanthracen-1-yl)sulfonylamino]-3-phenylpropanoic acid Traditional Name: (3S)-3-[(9,10-diketo-1-anthryl)sulfonylamino]-3-phenyl-propionic acid Formula: C23H17NO6S MolecularWeight: 435.44918

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)O)NS(=O)(=O)C2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)[C@H](CC(=O)O)NS(=O)(=O)C2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C23H17NO6S/c25-20(26)13-18(14-7-2-1-3-8-14)24-31(29,30)19-12-6-11-17-21(19)23(28)16-10-5-4-9-15(16)22(17)27/h1-12,18,24H,13H2,(H,25,26)/t18-/m0/s1