2-azanyl-4-[(4-methoxyphenyl)-oxidanyl-methyl]-6-methyl-imidazo[4,5-d]azepin-5-one

Systemtic Name: 2-azanyl-4-[(4-methoxyphenyl)-oxidanyl-methyl]-6-methyl-imidazo[4,5-d]azepin-5-one Openeye Name: 2-amino-4-[hydroxy-(4-methoxyphenyl)methyl]-6-methyl-imidazo[4,5-d]azepin-5-one CAS Name: 2-amino-4-[hydroxy-(4-methoxyphenyl)methyl]-6-methyl-5-imidazo[4,5-d]azepinone IUPAC Name: 2-amino-4-[hydroxy-(4-methoxyphenyl)methyl]-6-methylimidazo[4,5-d]azepin-5-one Traditional Name: 2-amino-4-[hydroxy-(4-methoxyphenyl)methyl]-6-methyl-imidaz[4,5-d]azepin-5-one Formula: C16H16N4O3 MolecularWeight: 312.32324

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=NC(=NC2=C(C1=O)C(C3=CC=C(C=C3)OC)O)N

Isomeric SMILES

CN1C=CC2=NC(=NC2=C(C1=O)C(C3=CC=C(C=C3)OC)O)N

InChI

InChI=1S/C16H16N4O3/c1-20-8-7-11-13(19-16(17)18-11)12(15(20)22)14(21)9-3-5-10(23-2)6-4-9/h3-8,14,21H,1-2H3,(H2,17,19)