N-cyclohexyl-2-[(4-methoxyphenyl)methyl]-5-nitro-3-oxidanylidene-1-pyridin-2-yl-isoindole-1-carboxamide

Systemtic Name: N-cyclohexyl-2-[(4-methoxyphenyl)methyl]-5-nitro-3-oxidanylidene-1-pyridin-2-yl-isoindole-1-carboxamide Openeye Name: N-cyclohexyl-2-[(4-methoxyphenyl)methyl]-5-nitro-3-oxo-1-(2-pyridyl)isoindoline-1-carboxamide CAS Name: N-cyclohexyl-2-[(4-methoxyphenyl)methyl]-5-nitro-3-oxo-1-(2-pyridinyl)-1-isoindolecarboxamide IUPAC Name: N-cyclohexyl-2-[(4-methoxyphenyl)methyl]-5-nitro-3-oxo-1-pyridin-2-ylisoindole-1-carboxamide Traditional Name: N-cyclohexyl-3-keto-5-nitro-2-p-anisyl-1-(2-pyridyl)isoindoline-1-carboxamide Formula: C28H28N4O5 MolecularWeight: 500.54572

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=O)C3=C(C2(C4=CC=CC=N4)C(=O)NC5CCCCC5)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(=O)C3=C(C2(C4=CC=CC=N4)C(=O)NC5CCCCC5)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C28H28N4O5/c1-37-22-13-10-19(11-14-22)18-31-26(33)23-17-21(32(35)36)12-15-24(23)28(31,25-9-5-6-16-29-25)27(34)30-20-7-3-2-4-8-20/h5-6,9-17,20H,2-4,7-8,18H2,1H3,(H,30,34)