2-azanyl-1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-phenyl-propan-1-one

Systemtic Name: 2-azanyl-1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-phenyl-propan-1-one Openeye Name: 2-amino-1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-phenyl-propan-1-one CAS Name: 2-amino-1-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-3-phenyl-1-propanone IUPAC Name: 2-amino-1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-phenylpropan-1-one Traditional Name: 2-amino-3-phenyl-1-(4-piperonylpiperazino)propan-1-one Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C(CC4=CC=CC=C4)N

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C(CC4=CC=CC=C4)N

InChI

InChI=1S/C21H25N3O3/c22-18(12-16-4-2-1-3-5-16)21(25)24-10-8-23(9-11-24)14-17-6-7-19-20(13-17)27-15-26-19/h1-7,13,18H,8-12,14-15,22H2