2-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-N-(pyridin-3-ylmethyl)-1H-quinoline-4-carboxamide

Systemtic Name: 2-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-N-(pyridin-3-ylmethyl)-1H-quinoline-4-carboxamide Openeye Name: 2-(4-oxocyclohexa-2,5-dien-1-ylidene)-N-(3-pyridylmethyl)-1H-quinoline-4-carboxamide CAS Name: 2-(4-oxo-1-cyclohexa-2,5-dienylidene)-N-(3-pyridinylmethyl)-1H-quinoline-4-carboxamide IUPAC Name: 2-(4-oxocyclohexa-2,5-dien-1-ylidene)-N-(pyridin-3-ylmethyl)-1H-quinoline-4-carboxamide Traditional Name: 2-(4-ketocyclohexa-2,5-dien-1-ylidene)-N-(3-pyridylmethyl)-1H-quinoline-4-carboxamide Formula: C22H17N3O2 MolecularWeight: 355.38928

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=C3C=CC(=O)C=C3)N2)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=C3C=CC(=O)C=C3)N2)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C22H17N3O2/c26-17-9-7-16(8-10-17)21-12-19(18-5-1-2-6-20(18)25-21)22(27)24-14-15-4-3-11-23-13-15/h1-13,25H,14H2,(H,24,27)