(2-nitrophenyl) 4-[3-[(4-imidazol-1-ylphenyl)carbamoyl]-6-methyl-pyridin-2-yl]piperidine-1-carboxylate

Systemtic Name: (2-nitrophenyl) 4-[3-[(4-imidazol-1-ylphenyl)carbamoyl]-6-methyl-pyridin-2-yl]piperidine-1-carboxylate Openeye Name: (2-nitrophenyl) 4-[3-[(4-imidazol-1-ylphenyl)carbamoyl]-6-methyl-2-pyridyl]piperidine-1-carboxylate CAS Name: 4-[3-[[4-(1-imidazolyl)anilino]-oxomethyl]-6-methyl-2-pyridinyl]-1-piperidinecarboxylic acid (2-nitrophenyl) ester IUPAC Name: (2-nitrophenyl) 4-[3-[(4-imidazol-1-ylphenyl)carbamoyl]-6-methylpyridin-2-yl]piperidine-1-carboxylate Traditional Name: 4-[3-[(4-imidazol-1-ylphenyl)carbamoyl]-6-methyl-2-pyridyl]piperidine-1-carboxylic acid (2-nitrophenyl) ester Formula: C28H26N6O5 MolecularWeight: 526.54324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)NC2=CC=C(C=C2)N3C=CN=C3)C4CCN(CC4)C(=O)OC5=CC=CC=C5[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)NC2=CC=C(C=C2)N3C=CN=C3)C4CCN(CC4)C(=O)OC5=CC=CC=C5[N+](=O)[O-]

InChI

InChI=1S/C28H26N6O5/c1-19-6-11-23(27(35)31-21-7-9-22(10-8-21)33-17-14-29-18-33)26(30-19)20-12-15-32(16-13-20)28(36)39-25-5-3-2-4-24(25)34(37)38/h2-11,14,17-18,20H,12-13,15-16H2,1H3,(H,31,35)