6-(cyclopropylmethoxy)-4-[(6-oxidanylidene-1H-pyridin-3-yl)carbonyl]-1-(phenylmethyl)-1,4-diazepan-2-one

Systemtic Name: 6-(cyclopropylmethoxy)-4-[(6-oxidanylidene-1H-pyridin-3-yl)carbonyl]-1-(phenylmethyl)-1,4-diazepan-2-one Openeye Name: 1-benzyl-6-(cyclopropylmethoxy)-4-(6-oxo-1H-pyridine-3-carbonyl)-1,4-diazepan-2-one CAS Name: 6-(cyclopropylmethoxy)-4-[oxo-(6-oxo-1H-pyridin-3-yl)methyl]-1-(phenylmethyl)-1,4-diazepan-2-one IUPAC Name: 1-benzyl-6-(cyclopropylmethoxy)-4-(6-oxo-1H-pyridine-3-carbonyl)-1,4-diazepan-2-one Traditional Name: 1-benzyl-6-(cyclopropylmethoxy)-4-(6-keto-1H-pyridine-3-carbonyl)-1,4-diazepan-2-one Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1COC2CN(CC(=O)N(C2)CC3=CC=CC=C3)C(=O)C4=CNC(=O)C=C4

Isomeric SMILES

C1CC1COC2CN(CC(=O)N(C2)CC3=CC=CC=C3)C(=O)C4=CNC(=O)C=C4

InChI

InChI=1S/C22H25N3O4/c26-20-9-8-18(10-23-20)22(28)25-13-19(29-15-17-6-7-17)12-24(21(27)14-25)11-16-4-2-1-3-5-16/h1-5,8-10,17,19H,6-7,11-15H2,(H,23,26)