1-phenyl-4-(4,5,7,8-tetrahydro-1H-imidazo[4,5-d]azepin-6-yl)butane-1,4-dione

Systemtic Name: 1-phenyl-4-(4,5,7,8-tetrahydro-1H-imidazo[4,5-d]azepin-6-yl)butane-1,4-dione Openeye Name: 1-phenyl-4-(4,5,7,8-tetrahydro-1H-imidazo[4,5-d]azepin-6-yl)butane-1,4-dione CAS Name: 1-phenyl-4-(4,5,7,8-tetrahydro-1H-imidazo[4,5-d]azepin-6-yl)butane-1,4-dione IUPAC Name: 1-phenyl-4-(4,5,7,8-tetrahydro-1H-imidazo[4,5-d]azepin-6-yl)butane-1,4-dione Traditional Name: 1-phenyl-4-(4,5,7,8-tetrahydro-1H-imidaz[4,5-d]azepin-6-yl)butane-1,4-dione Formula: C17H19N3O2 MolecularWeight: 297.35166

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC2=C1NC=N2)C(=O)CCC(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCC2=C1NC=N2)C(=O)CCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H19N3O2/c21-16(13-4-2-1-3-5-13)6-7-17(22)20-10-8-14-15(9-11-20)19-12-18-14/h1-5,12H,6-11H2,(H,18,19)