5-(cyclopropylcarbamoyl)-1-heptyl-2,6-dimethyl-4-(2-nitrophenyl)-4H-pyridine-3-carboxylic acid

Systemtic Name: 5-(cyclopropylcarbamoyl)-1-heptyl-2,6-dimethyl-4-(2-nitrophenyl)-4H-pyridine-3-carboxylic acid Openeye Name: 5-(cyclopropylcarbamoyl)-1-heptyl-2,6-dimethyl-4-(2-nitrophenyl)-4H-pyridine-3-carboxylic acid CAS Name: 5-[(cyclopropylamino)-oxomethyl]-1-heptyl-2,6-dimethyl-4-(2-nitrophenyl)-4H-pyridine-3-carboxylic acid IUPAC Name: 5-(cyclopropylcarbamoyl)-1-heptyl-2,6-dimethyl-4-(2-nitrophenyl)-4H-pyridine-3-carboxylic acid Traditional Name: 5-(cyclopropylcarbamoyl)-1-heptyl-2,6-dimethyl-4-(2-nitrophenyl)-4H-pyridine-3-carboxylic acid Formula: C25H33N3O5 MolecularWeight: 455.54662

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C(=C(C(C(=C1C)C(=O)O)C2=CC=CC=C2[N+](=O)[O-])C(=O)NC3CC3)C

Isomeric SMILES

CCCCCCCN1C(=C(C(C(=C1C)C(=O)O)C2=CC=CC=C2[N+](=O)[O-])C(=O)NC3CC3)C

InChI

InChI=1S/C25H33N3O5/c1-4-5-6-7-10-15-27-16(2)21(24(29)26-18-13-14-18)23(22(17(27)3)25(30)31)19-11-8-9-12-20(19)28(32)33/h8-9,11-12,18,23H,4-7,10,13-15H2,1-3H3,(H,26,29)(H,30,31)