3-(1,3-benzodioxol-5-yl)-N-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]propanamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]propanamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-[2-(4-benzylpiperazin-1-yl)ethyl]propanamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-[2-[4-(phenylmethyl)-1-piperazinyl]ethyl]propanamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-[2-(4-benzylpiperazin-1-yl)ethyl]propanamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-[2-(4-benzylpiperazino)ethyl]propionamide Formula: C23H29N3O3 MolecularWeight: 395.49466

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNC(=O)CCC2=CC3=C(C=C2)OCO3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CCNC(=O)CCC2=CC3=C(C=C2)OCO3)CC4=CC=CC=C4

InChI

InChI=1S/C23H29N3O3/c27-23(9-7-19-6-8-21-22(16-19)29-18-28-21)24-10-11-25-12-14-26(15-13-25)17-20-4-2-1-3-5-20/h1-6,8,16H,7,9-15,17-18H2,(H,24,27)