4-(1,3-benzodioxol-4-ylmethyl)-6-methoxy-1-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-1,4-diazepan-2-one

Systemtic Name: 4-(1,3-benzodioxol-4-ylmethyl)-6-methoxy-1-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-1,4-diazepan-2-one Openeye Name: 4-(1,3-benzodioxol-4-ylmethyl)-6-methoxy-1-[3-(2-oxopyrrolidin-1-yl)propyl]-1,4-diazepan-2-one CAS Name: 4-(1,3-benzodioxol-4-ylmethyl)-6-methoxy-1-[3-(2-oxo-1-pyrrolidinyl)propyl]-1,4-diazepan-2-one IUPAC Name: 4-(1,3-benzodioxol-4-ylmethyl)-6-methoxy-1-[3-(2-oxopyrrolidin-1-yl)propyl]-1,4-diazepan-2-one Traditional Name: 4-(1,3-benzodioxol-4-ylmethyl)-1-[3-(2-ketopyrrolidino)propyl]-6-methoxy-1,4-diazepan-2-one Formula: C21H29N3O5 MolecularWeight: 403.47206

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Descriptors Computed from Structure

Canonical SMILES:

COC1CN(CC(=O)N(C1)CCCN2CCCC2=O)CC3=C4C(=CC=C3)OCO4

Isomeric SMILES

COC1CN(CC(=O)N(C1)CCCN2CCCC2=O)CC3=C4C(=CC=C3)OCO4

InChI

InChI=1S/C21H29N3O5/c1-27-17-12-22(11-16-5-2-6-18-21(16)29-15-28-18)14-20(26)24(13-17)10-4-9-23-8-3-7-19(23)25/h2,5-6,17H,3-4,7-15H2,1H3