1-[1-[3-(benzimidazol-1-yl)-2-oxidanyl-propyl]-5-ethanoyl-2,6-dimethyl-4-(4-nitrophenyl)-4H-pyridin-3-yl]ethanone

Systemtic Name: 1-[1-[3-(benzimidazol-1-yl)-2-oxidanyl-propyl]-5-ethanoyl-2,6-dimethyl-4-(4-nitrophenyl)-4H-pyridin-3-yl]ethanone Openeye Name: 1-[5-acetyl-1-[3-(benzimidazol-1-yl)-2-hydroxy-propyl]-2,6-dimethyl-4-(4-nitrophenyl)-4H-pyridin-3-yl]ethanone CAS Name: 1-[5-acetyl-1-[3-(1-benzimidazolyl)-2-hydroxypropyl]-2,6-dimethyl-4-(4-nitrophenyl)-4H-pyridin-3-yl]ethanone IUPAC Name: 1-[5-acetyl-1-[3-(benzimidazol-1-yl)-2-hydroxypropyl]-2,6-dimethyl-4-(4-nitrophenyl)-4H-pyridin-3-yl]ethanone Traditional Name: 1-[5-acetyl-1-[3-(benzimidazol-1-yl)-2-hydroxy-propyl]-2,6-dimethyl-4-(4-nitrophenyl)-4H-pyridin-3-yl]ethanone Formula: C27H28N4O5 MolecularWeight: 488.53502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1CC(CN2C=NC3=CC=CC=C32)O)C)C(=O)C)C4=CC=C(C=C4)[N+](=O)[O-])C(=O)C

Isomeric SMILES

CC1=C(C(C(=C(N1CC(CN2C=NC3=CC=CC=C32)O)C)C(=O)C)C4=CC=C(C=C4)[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C27H28N4O5/c1-16-25(18(3)32)27(20-9-11-21(12-10-20)31(35)36)26(19(4)33)17(2)30(16)14-22(34)13-29-15-28-23-7-5-6-8-24(23)29/h5-12,15,22,27,34H,13-14H2,1-4H3