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

Systemtic Name: [4-[cyclopropyl-[(4-nitrophenyl)methyl]amino]-1-(3-methoxyphenyl)carbonyl-pyrrolidin-2-yl]-piperazin-1-yl-methanone Openeye Name: [4-[cyclopropyl-[(4-nitrophenyl)methyl]amino]-1-(3-methoxybenzoyl)pyrrolidin-2-yl]-piperazin-1-yl-methanone CAS Name: [4-[cyclopropyl-[(4-nitrophenyl)methyl]amino]-1-[(3-methoxyphenyl)-oxomethyl]-2-pyrrolidinyl]-(1-piperazinyl)methanone IUPAC Name: [4-[cyclopropyl-[(4-nitrophenyl)methyl]amino]-1-(3-methoxybenzoyl)pyrrolidin-2-yl]-piperazin-1-ylmethanone Traditional Name: [4-[cyclopropyl-(4-nitrobenzyl)amino]-1-m-anisoyl-pyrrolidin-2-yl]-piperazino-methanone Formula: C27H33N5O5 MolecularWeight: 507.58142

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)N2CC(CC2C(=O)N3CCNCC3)N(CC4=CC=C(C=C4)[N+](=O)[O-])C5CC5

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N2CC(CC2C(=O)N3CCNCC3)N(CC4=CC=C(C=C4)[N+](=O)[O-])C5CC5

InChI

InChI=1S/C27H33N5O5/c1-37-24-4-2-3-20(15-24)26(33)31-18-23(16-25(31)27(34)29-13-11-28-12-14-29)30(21-9-10-21)17-19-5-7-22(8-6-19)32(35)36/h2-8,15,21,23,25,28H,9-14,16-18H2,1H3