4-[(2Z)-2-[5-bromanyl-2-oxidanylidene-1-(phenylmethyl)indol-3-ylidene]hydrazinyl]benzoic acid

Systemtic Name: 4-[(2Z)-2-[5-bromanyl-2-oxidanylidene-1-(phenylmethyl)indol-3-ylidene]hydrazinyl]benzoic acid Openeye Name: 4-[(2Z)-2-(1-benzyl-5-bromo-2-oxo-indolin-3-ylidene)hydrazino]benzoic acid CAS Name: 4-[(2Z)-2-[5-bromo-2-oxo-1-(phenylmethyl)-3-indolylidene]hydrazinyl]benzoic acid IUPAC Name: 4-[(2Z)-2-(1-benzyl-5-bromo-2-oxoindol-3-ylidene)hydrazinyl]benzoic acid Traditional Name: 4-[(N'Z)-N'-(1-benzyl-5-bromo-2-keto-indolin-3-ylidene)hydrazino]benzoic acid Formula: C22H16BrN3O3 MolecularWeight: 450.28474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)Br)C(=NNC4=CC=C(C=C4)C(=O)O)C2=O

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)Br)/C(=N/NC4=CC=C(C=C4)C(=O)O)/C2=O

InChI

InChI=1S/C22H16BrN3O3/c23-16-8-11-19-18(12-16)20(21(27)26(19)13-14-4-2-1-3-5-14)25-24-17-9-6-15(7-10-17)22(28)29/h1-12,24H,13H2,(H,28,29)/b25-20-