2-methoxy-1-[4-[phenethyl-(phenylmethyl)amino]-2-piperazin-1-ylcarbonyl-pyrrolidin-1-yl]ethanone

Systemtic Name: 2-methoxy-1-[4-[phenethyl-(phenylmethyl)amino]-2-piperazin-1-ylcarbonyl-pyrrolidin-1-yl]ethanone Openeye Name: 1-[4-[benzyl(phenethyl)amino]-2-(piperazine-1-carbonyl)pyrrolidin-1-yl]-2-methoxy-ethanone CAS Name: 2-methoxy-1-[2-[oxo(1-piperazinyl)methyl]-4-[phenethyl-(phenylmethyl)amino]-1-pyrrolidinyl]ethanone IUPAC Name: 1-[4-[benzyl(phenethyl)amino]-2-(piperazine-1-carbonyl)pyrrolidin-1-yl]-2-methoxyethanone Traditional Name: 1-[4-[benzyl(phenethyl)amino]-2-(piperazine-1-carbonyl)pyrrolidino]-2-methoxy-ethanone Formula: C27H36N4O3 MolecularWeight: 464.59974

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Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)N1CC(CC1C(=O)N2CCNCC2)N(CCC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

COCC(=O)N1CC(CC1C(=O)N2CCNCC2)N(CCC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C27H36N4O3/c1-34-21-26(32)31-20-24(18-25(31)27(33)29-16-13-28-14-17-29)30(19-23-10-6-3-7-11-23)15-12-22-8-4-2-5-9-22/h2-11,24-25,28H,12-21H2,1H3