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

Systemtic Name: [4-[(3-methoxyphenyl)methyl-[(4-nitrophenyl)methyl]amino]-1-pyridin-3-ylcarbonyl-pyrrolidin-2-yl]-piperazin-1-yl-methanone Openeye Name: [4-[(3-methoxyphenyl)methyl-[(4-nitrophenyl)methyl]amino]-1-(pyridine-3-carbonyl)pyrrolidin-2-yl]-piperazin-1-yl-methanone CAS Name: [4-[(3-methoxyphenyl)methyl-[(4-nitrophenyl)methyl]amino]-1-[oxo(3-pyridinyl)methyl]-2-pyrrolidinyl]-(1-piperazinyl)methanone IUPAC Name: [4-[(3-methoxyphenyl)methyl-[(4-nitrophenyl)methyl]amino]-1-(pyridine-3-carbonyl)pyrrolidin-2-yl]-piperazin-1-ylmethanone Traditional Name: [4-[m-anisyl-(4-nitrobenzyl)amino]-1-nicotinoyl-pyrrolidin-2-yl]-piperazino-methanone Formula: C30H34N6O5 MolecularWeight: 558.62816

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN(CC2=CC=C(C=C2)[N+](=O)[O-])C3CC(N(C3)C(=O)C4=CN=CC=C4)C(=O)N5CCNCC5

Isomeric SMILES

COC1=CC=CC(=C1)CN(CC2=CC=C(C=C2)[N+](=O)[O-])C3CC(N(C3)C(=O)C4=CN=CC=C4)C(=O)N5CCNCC5

InChI

InChI=1S/C30H34N6O5/c1-41-27-6-2-4-23(16-27)20-34(19-22-7-9-25(10-8-22)36(39)40)26-17-28(30(38)33-14-12-31-13-15-33)35(21-26)29(37)24-5-3-11-32-18-24/h2-11,16,18,26,28,31H,12-15,17,19-21H2,1H3