4-[(4Z)-3-azanyl-5-oxidanylidene-4-[(1-phenacylindol-3-yl)methylidene]pyrazol-1-yl]benzoic acid

Systemtic Name: 4-[(4Z)-3-azanyl-5-oxidanylidene-4-[(1-phenacylindol-3-yl)methylidene]pyrazol-1-yl]benzoic acid Openeye Name: 4-[(4Z)-3-amino-5-oxo-4-[(1-phenacylindol-3-yl)methylene]pyrazol-1-yl]benzoic acid CAS Name: 4-[(4Z)-3-amino-5-oxo-4-[(1-phenacyl-3-indolyl)methylidene]-1-pyrazolyl]benzoic acid IUPAC Name: 4-[(4Z)-3-amino-5-oxo-4-[(1-phenacylindol-3-yl)methylidene]pyrazol-1-yl]benzoic acid Traditional Name: 4-[(4Z)-3-amino-5-keto-4-[(1-phenacylindol-3-yl)methylene]-2-pyrazolin-1-yl]benzoic acid Formula: C27H20N4O4 MolecularWeight: 464.4721

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CN2C=C(C3=CC=CC=C32)C=C4C(=NN(C4=O)C5=CC=C(C=C5)C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CN2C=C(C3=CC=CC=C32)/C=C\4/C(=NN(C4=O)C5=CC=C(C=C5)C(=O)O)N

InChI

InChI=1S/C27H20N4O4/c28-25-22(26(33)31(29-25)20-12-10-18(11-13-20)27(34)35)14-19-15-30(23-9-5-4-8-21(19)23)16-24(32)17-6-2-1-3-7-17/h1-15H,16H2,(H2,28,29)(H,34,35)/b22-14-