1-heptyl-2,6-dimethyl-4-(2-nitrophenyl)-5-(propan-2-ylcarbamoyl)-4H-pyridine-3-carboxylate

Systemtic Name: 1-heptyl-2,6-dimethyl-4-(2-nitrophenyl)-5-(propan-2-ylcarbamoyl)-4H-pyridine-3-carboxylate Openeye Name: 1-heptyl-5-(isopropylcarbamoyl)-2,6-dimethyl-4-(2-nitrophenyl)-4H-pyridine-3-carboxylate CAS Name: 1-heptyl-2,6-dimethyl-4-(2-nitrophenyl)-5-[oxo-(propan-2-ylamino)methyl]-4H-pyridine-3-carboxylate IUPAC Name: 1-heptyl-2,6-dimethyl-4-(2-nitrophenyl)-5-(propan-2-ylcarbamoyl)-4H-pyridine-3-carboxylate Traditional Name: 1-heptyl-5-(isopropylcarbamoyl)-2,6-dimethyl-4-(2-nitrophenyl)-4H-pyridine-3-carboxylate Formula: C25H34N3O5- MolecularWeight: 456.55456

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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)NC(C)C)C

Isomeric SMILES

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

InChI

InChI=1S/C25H35N3O5/c1-6-7-8-9-12-15-27-17(4)21(24(29)26-16(2)3)23(22(18(27)5)25(30)31)19-13-10-11-14-20(19)28(32)33/h10-11,13-14,16,23H,6-9,12,15H2,1-5H3,(H,26,29)(H,30,31)/p-1