(2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(3-methoxyphenyl)piperazin-1-yl]propanamide

Systemtic Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(3-methoxyphenyl)piperazin-1-yl]propanamide Openeye Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(3-methoxyphenyl)piperazin-1-yl]propanamide CAS Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(3-methoxyphenyl)-1-piperazinyl]propanamide IUPAC Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(3-methoxyphenyl)piperazin-1-yl]propanamide Traditional Name: (2R)-2-[4-(3-methoxyphenyl)piperazino]-N-piperonyl-propionamide Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC2=C(C=C1)OCO2)N3CCN(CC3)C4=CC(=CC=C4)OC

Isomeric SMILES

C[C@H](C(=O)NCC1=CC2=C(C=C1)OCO2)N3CCN(CC3)C4=CC(=CC=C4)OC

InChI

InChI=1S/C22H27N3O4/c1-16(22(26)23-14-17-6-7-20-21(12-17)29-15-28-20)24-8-10-25(11-9-24)18-4-3-5-19(13-18)27-2/h3-7,12-13,16H,8-11,14-15H2,1-2H3,(H,23,26)/t16-/m1/s1