cyclopropyl-[4-[(3-methoxyphenyl)methyl-(phenylmethyl)amino]-2-piperazin-1-ylcarbonyl-pyrrolidin-1-yl]methanone

Systemtic Name: cyclopropyl-[4-[(3-methoxyphenyl)methyl-(phenylmethyl)amino]-2-piperazin-1-ylcarbonyl-pyrrolidin-1-yl]methanone Openeye Name: [4-[benzyl-[(3-methoxyphenyl)methyl]amino]-2-(piperazine-1-carbonyl)pyrrolidin-1-yl]-cyclopropyl-methanone CAS Name: cyclopropyl-[4-[(3-methoxyphenyl)methyl-(phenylmethyl)amino]-2-[oxo(1-piperazinyl)methyl]-1-pyrrolidinyl]methanone IUPAC Name: [4-[benzyl-[(3-methoxyphenyl)methyl]amino]-2-(piperazine-1-carbonyl)pyrrolidin-1-yl]-cyclopropylmethanone Traditional Name: [4-[benzyl(m-anisyl)amino]-2-(piperazine-1-carbonyl)pyrrolidino]-cyclopropyl-methanone Formula: C28H36N4O3 MolecularWeight: 476.61044

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN(CC2=CC=CC=C2)C3CC(N(C3)C(=O)C4CC4)C(=O)N5CCNCC5

Isomeric SMILES

COC1=CC=CC(=C1)CN(CC2=CC=CC=C2)C3CC(N(C3)C(=O)C4CC4)C(=O)N5CCNCC5

InChI

InChI=1S/C28H36N4O3/c1-35-25-9-5-8-22(16-25)19-31(18-21-6-3-2-4-7-21)24-17-26(28(34)30-14-12-29-13-15-30)32(20-24)27(33)23-10-11-23/h2-9,16,23-24,26,29H,10-15,17-20H2,1H3