6-(cyclopropylmethoxy)-1-[(3-methoxyphenyl)methyl]-4-(1-pyridin-2-ylpiperidin-3-yl)carbonyl-1,4-diazepan-2-one

Systemtic Name: 6-(cyclopropylmethoxy)-1-[(3-methoxyphenyl)methyl]-4-(1-pyridin-2-ylpiperidin-3-yl)carbonyl-1,4-diazepan-2-one Openeye Name: 6-(cyclopropylmethoxy)-1-[(3-methoxyphenyl)methyl]-4-[1-(2-pyridyl)piperidine-3-carbonyl]-1,4-diazepan-2-one CAS Name: 6-(cyclopropylmethoxy)-1-[(3-methoxyphenyl)methyl]-4-[oxo-[1-(2-pyridinyl)-3-piperidinyl]methyl]-1,4-diazepan-2-one IUPAC Name: 6-(cyclopropylmethoxy)-1-[(3-methoxyphenyl)methyl]-4-(1-pyridin-2-ylpiperidine-3-carbonyl)-1,4-diazepan-2-one Traditional Name: 6-(cyclopropylmethoxy)-1-m-anisyl-4-[1-(2-pyridyl)nipecotoyl]-1,4-diazepan-2-one Formula: C28H36N4O4 MolecularWeight: 492.60984

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN2CC(CN(CC2=O)C(=O)C3CCCN(C3)C4=CC=CC=N4)OCC5CC5

Isomeric SMILES

COC1=CC=CC(=C1)CN2CC(CN(CC2=O)C(=O)C3CCCN(C3)C4=CC=CC=N4)OCC5CC5

InChI

InChI=1S/C28H36N4O4/c1-35-24-8-4-6-22(14-24)15-31-17-25(36-20-21-10-11-21)18-32(19-27(31)33)28(34)23-7-5-13-30(16-23)26-9-2-3-12-29-26/h2-4,6,8-9,12,14,21,23,25H,5,7,10-11,13,15-20H2,1H3