3-(1,3-benzodioxol-5-yl)-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]propanamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]propanamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]propanamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-[2-(3-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]propanamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]propanamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-[2-(3-methoxyphenyl)-2-pyrrolidino-ethyl]propionamide Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(CNC(=O)CCC2=CC3=C(C=C2)OCO3)N4CCCC4

Isomeric SMILES

COC1=CC=CC(=C1)C(CNC(=O)CCC2=CC3=C(C=C2)OCO3)N4CCCC4

InChI

InChI=1S/C23H28N2O4/c1-27-19-6-4-5-18(14-19)20(25-11-2-3-12-25)15-24-23(26)10-8-17-7-9-21-22(13-17)29-16-28-21/h4-7,9,13-14,20H,2-3,8,10-12,15-16H2,1H3,(H,24,26)