(2-nitrophenyl) 4-[3-(1,3-dihydroisoindol-2-ylcarbonyl)-6-methyl-pyridin-2-yl]piperidine-1-carboxylate

Systemtic Name: (2-nitrophenyl) 4-[3-(1,3-dihydroisoindol-2-ylcarbonyl)-6-methyl-pyridin-2-yl]piperidine-1-carboxylate Openeye Name: (2-nitrophenyl) 4-[3-(isoindoline-2-carbonyl)-6-methyl-2-pyridyl]piperidine-1-carboxylate CAS Name: 4-[3-[1,3-dihydroisoindol-2-yl(oxo)methyl]-6-methyl-2-pyridinyl]-1-piperidinecarboxylic acid (2-nitrophenyl) ester IUPAC Name: (2-nitrophenyl) 4-[3-(1,3-dihydroisoindole-2-carbonyl)-6-methylpyridin-2-yl]piperidine-1-carboxylate Traditional Name: 4-[3-(isoindoline-2-carbonyl)-6-methyl-2-pyridyl]piperidine-1-carboxylic acid (2-nitrophenyl) ester Formula: C27H26N4O5 MolecularWeight: 486.51914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)N2CC3=CC=CC=C3C2)C4CCN(CC4)C(=O)OC5=CC=CC=C5[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)N2CC3=CC=CC=C3C2)C4CCN(CC4)C(=O)OC5=CC=CC=C5[N+](=O)[O-]

InChI

InChI=1S/C27H26N4O5/c1-18-10-11-22(26(32)30-16-20-6-2-3-7-21(20)17-30)25(28-18)19-12-14-29(15-13-19)27(33)36-24-9-5-4-8-23(24)31(34)35/h2-11,19H,12-17H2,1H3