1-[2-azanyl-2-piperidin-4-yl-3-(1H-pyrrol-2-ylmethyl)piperazin-1-yl]ethanone

Systemtic Name: 1-[2-azanyl-2-piperidin-4-yl-3-(1H-pyrrol-2-ylmethyl)piperazin-1-yl]ethanone Openeye Name: 1-[2-amino-2-(4-piperidyl)-3-(1H-pyrrol-2-ylmethyl)piperazin-1-yl]ethanone CAS Name: 1-[2-amino-2-(4-piperidinyl)-3-(1H-pyrrol-2-ylmethyl)-1-piperazinyl]ethanone IUPAC Name: 1-[2-amino-2-piperidin-4-yl-3-(1H-pyrrol-2-ylmethyl)piperazin-1-yl]ethanone Traditional Name: 1-[2-amino-2-(4-piperidyl)-3-(1H-pyrrol-2-ylmethyl)piperazino]ethanone Formula: C16H27N5O MolecularWeight: 305.41848

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCNC(C1(C2CCNCC2)N)CC3=CC=CN3

Isomeric SMILES

CC(=O)N1CCNC(C1(C2CCNCC2)N)CC3=CC=CN3

InChI

InChI=1S/C16H27N5O/c1-12(22)21-10-9-20-15(11-14-3-2-6-19-14)16(21,17)13-4-7-18-8-5-13/h2-3,6,13,15,18-20H,4-5,7-11,17H2,1H3