3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-[(1S)-1-phenylethyl]propanamide

Systemtic Name: 3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-[(1S)-1-phenylethyl]propanamide Openeye Name: 3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-[(1S)-1-phenylethyl]propanamide CAS Name: 3-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-N-[(1S)-1-phenylethyl]propanamide IUPAC Name: 3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-[(1S)-1-phenylethyl]propanamide Traditional Name: N-[(1S)-1-phenylethyl]-3-(4-piperonylpiperazino)propionamide Formula: C23H29N3O3 MolecularWeight: 395.49466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)CCN2CCN(CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)NC(=O)CCN2CCN(CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H29N3O3/c1-18(20-5-3-2-4-6-20)24-23(27)9-10-25-11-13-26(14-12-25)16-19-7-8-21-22(15-19)29-17-28-21/h2-8,15,18H,9-14,16-17H2,1H3,(H,24,27)/t18-/m0/s1