3-phenyl-6,7,8,9-tetrahydro-5H-pyrimido[1,6-a]azepin-1-one

Systemtic Name: 3-phenyl-6,7,8,9-tetrahydro-5H-pyrimido[1,6-a]azepin-1-one Openeye Name: 3-phenyl-6,7,8,9-tetrahydro-5H-pyrimido[1,6-a]azepin-1-one CAS Name: 3-phenyl-6,7,8,9-tetrahydro-5H-pyrimido[1,6-a]azepin-1-one IUPAC Name: 3-phenyl-6,7,8,9-tetrahydro-5H-pyrimido[1,6-a]azepin-1-one Traditional Name: 3-phenyl-6,7,8,9-tetrahydro-5H-pyrimid[1,6-a]azepin-1-one Formula: C15H16N2O MolecularWeight: 240.30034

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=CC(=NC(=O)N2CC1)C3=CC=CC=C3

Isomeric SMILES

C1CCC2=CC(=NC(=O)N2CC1)C3=CC=CC=C3

InChI

InChI=1S/C15H16N2O/c18-15-16-14(12-7-3-1-4-8-12)11-13-9-5-2-6-10-17(13)15/h1,3-4,7-8,11H,2,5-6,9-10H2