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

Systemtic Name: [4-[cyclopropyl-[(4-nitrophenyl)methyl]amino]-1-pyridin-3-ylcarbonyl-pyrrolidin-2-yl]-piperazin-1-yl-methanone Openeye Name: [4-[cyclopropyl-[(4-nitrophenyl)methyl]amino]-1-(pyridine-3-carbonyl)pyrrolidin-2-yl]-piperazin-1-yl-methanone CAS Name: [4-[cyclopropyl-[(4-nitrophenyl)methyl]amino]-1-[oxo(3-pyridinyl)methyl]-2-pyrrolidinyl]-(1-piperazinyl)methanone IUPAC Name: [4-[cyclopropyl-[(4-nitrophenyl)methyl]amino]-1-(pyridine-3-carbonyl)pyrrolidin-2-yl]-piperazin-1-ylmethanone Traditional Name: [4-[cyclopropyl-(4-nitrobenzyl)amino]-1-nicotinoyl-pyrrolidin-2-yl]-piperazino-methanone Formula: C25H30N6O4 MolecularWeight: 478.5435

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CC2=CC=C(C=C2)[N+](=O)[O-])C3CC(N(C3)C(=O)C4=CN=CC=C4)C(=O)N5CCNCC5

Isomeric SMILES

C1CC1N(CC2=CC=C(C=C2)[N+](=O)[O-])C3CC(N(C3)C(=O)C4=CN=CC=C4)C(=O)N5CCNCC5

InChI

InChI=1S/C25H30N6O4/c32-24(19-2-1-9-27-15-19)30-17-22(14-23(30)25(33)28-12-10-26-11-13-28)29(20-7-8-20)16-18-3-5-21(6-4-18)31(34)35/h1-6,9,15,20,22-23,26H,7-8,10-14,16-17H2