6-(cyclopropylmethoxy)-1-[(3-methoxyphenyl)methyl]-4-(5-oxidanylidene-1-prop-2-enyl-pyrrolidin-3-yl)carbonyl-1,4-diazepan-2-one

Systemtic Name: 6-(cyclopropylmethoxy)-1-[(3-methoxyphenyl)methyl]-4-(5-oxidanylidene-1-prop-2-enyl-pyrrolidin-3-yl)carbonyl-1,4-diazepan-2-one Openeye Name: 4-(1-allyl-5-oxo-pyrrolidine-3-carbonyl)-6-(cyclopropylmethoxy)-1-[(3-methoxyphenyl)methyl]-1,4-diazepan-2-one CAS Name: 6-(cyclopropylmethoxy)-1-[(3-methoxyphenyl)methyl]-4-[oxo-(5-oxo-1-prop-2-enyl-3-pyrrolidinyl)methyl]-1,4-diazepan-2-one IUPAC Name: 6-(cyclopropylmethoxy)-1-[(3-methoxyphenyl)methyl]-4-(5-oxo-1-prop-2-enylpyrrolidine-3-carbonyl)-1,4-diazepan-2-one Traditional Name: 4-(1-allyl-5-keto-pyrrolidine-3-carbonyl)-6-(cyclopropylmethoxy)-1-m-anisyl-1,4-diazepan-2-one Formula: C25H33N3O5 MolecularWeight: 455.54662

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN2CC(CN(CC2=O)C(=O)C3CC(=O)N(C3)CC=C)OCC4CC4

Isomeric SMILES

COC1=CC=CC(=C1)CN2CC(CN(CC2=O)C(=O)C3CC(=O)N(C3)CC=C)OCC4CC4

InChI

InChI=1S/C25H33N3O5/c1-3-9-26-13-20(11-23(26)29)25(31)28-15-22(33-17-18-7-8-18)14-27(24(30)16-28)12-19-5-4-6-21(10-19)32-2/h3-6,10,18,20,22H,1,7-9,11-17H2,2H3