(Z)-4-oxidanyl-2-oxidanylidene-4-[1-(phenylmethyl)indol-2-yl]but-3-enoic acid

Systemtic Name: (Z)-4-oxidanyl-2-oxidanylidene-4-[1-(phenylmethyl)indol-2-yl]but-3-enoic acid Openeye Name: (Z)-4-(1-benzylindol-2-yl)-4-hydroxy-2-oxo-but-3-enoic acid CAS Name: (Z)-4-hydroxy-2-oxo-4-[1-(phenylmethyl)-2-indolyl]-3-butenoic acid IUPAC Name: (Z)-4-(1-benzylindol-2-yl)-4-hydroxy-2-oxobut-3-enoic acid Traditional Name: (Z)-4-(1-benzylindol-2-yl)-4-hydroxy-2-keto-but-3-enoic acid Formula: C19H15NO4 MolecularWeight: 321.3267

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=CC=CC=C3C=C2C(=CC(=O)C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=CC=CC=C3C=C2/C(=C/C(=O)C(=O)O)/O

InChI

InChI=1S/C19H15NO4/c21-17(11-18(22)19(23)24)16-10-14-8-4-5-9-15(14)20(16)12-13-6-2-1-3-7-13/h1-11,21H,12H2,(H,23,24)/b17-11-