2-cyano-3-(1-cyclohexa-2,5-dien-1-yl-8bH-indeno[1,2-c]pyrazol-3-yl)-N-[4-(hydroxymethyl)-3-oxidanyl-phenyl]-3-oxidanylidene-propanamide

Systemtic Name: 2-cyano-3-(1-cyclohexa-2,5-dien-1-yl-8bH-indeno[1,2-c]pyrazol-3-yl)-N-[4-(hydroxymethyl)-3-oxidanyl-phenyl]-3-oxidanylidene-propanamide Openeye Name: 2-cyano-3-(1-cyclohexa-2,5-dien-1-yl-8bH-indeno[1,2-c]pyrazol-3-yl)-N-[3-hydroxy-4-(hydroxymethyl)phenyl]-3-oxo-propanamide CAS Name: 2-cyano-3-[1-(1-cyclohexa-2,5-dienyl)-8bH-indeno[1,2-c]pyrazol-3-yl]-N-[3-hydroxy-4-(hydroxymethyl)phenyl]-3-oxopropanamide IUPAC Name: 2-cyano-3-(1-cyclohexa-2,5-dien-1-yl-8bH-indeno[1,2-c]pyrazol-3-yl)-N-[3-hydroxy-4-(hydroxymethyl)phenyl]-3-oxopropanamide Traditional Name: 2-cyano-3-(1-cyclohexa-2,5-dien-1-yl-8bH-indeno[1,2-c]pyrazol-3-yl)-N-(3-hydroxy-4-methylol-phenyl)-3-keto-propionamide Formula: C27H22N4O4 MolecularWeight: 466.48798

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC(C=C1)N2C3C4=CC=CC=C4C=C3C(=N2)C(=O)C(C#N)C(=O)NC5=CC(=C(C=C5)CO)O

Isomeric SMILES

C1C=CC(C=C1)N2C3C4=CC=CC=C4C=C3C(=N2)C(=O)C(C#N)C(=O)NC5=CC(=C(C=C5)CO)O

InChI

InChI=1S/C27H22N4O4/c28-14-22(27(35)29-18-11-10-17(15-32)23(33)13-18)26(34)24-21-12-16-6-4-5-9-20(16)25(21)31(30-24)19-7-2-1-3-8-19/h2-13,19,22,25,32-33H,1,15H2,(H,29,35)