13-oxidanylidene-N-phenyl-6,7,8,9,10,11-hexahydroazocino[2,1-b]quinazoline-3-carboxamide

Systemtic Name: 13-oxidanylidene-N-phenyl-6,7,8,9,10,11-hexahydroazocino[2,1-b]quinazoline-3-carboxamide Openeye Name: 13-oxo-N-phenyl-6,7,8,9,10,11-hexahydroazocino[2,1-b]quinazoline-3-carboxamide CAS Name: 13-oxo-N-phenyl-6,7,8,9,10,11-hexahydroazocino[2,1-b]quinazoline-3-carboxamide IUPAC Name: 13-oxo-N-phenyl-6,7,8,9,10,11-hexahydroazocino[2,1-b]quinazoline-3-carboxamide Traditional Name: 13-keto-N-phenyl-6,7,8,9,10,11-hexahydroazocino[2,1-b]quinazoline-3-carboxamide Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN2C(=NC3=C(C2=O)C=CC(=C3)C(=O)NC4=CC=CC=C4)CC1

Isomeric SMILES

C1CCCN2C(=NC3=C(C2=O)C=CC(=C3)C(=O)NC4=CC=CC=C4)CC1

InChI

InChI=1S/C21H21N3O2/c25-20(22-16-8-4-3-5-9-16)15-11-12-17-18(14-15)23-19-10-6-1-2-7-13-24(19)21(17)26/h3-5,8-9,11-12,14H,1-2,6-7,10,13H2,(H,22,25)