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

Systemtic Name: 5-(2-acetamidoethoxycarbonyl)-2,6-dimethyl-1-(4-nitrophenyl)-4H-pyridine-3-carboxylic acid Openeye Name: 5-(2-acetamidoethoxycarbonyl)-2,6-dimethyl-1-(4-nitrophenyl)-4H-pyridine-3-carboxylic acid CAS Name: 5-[2-acetamidoethoxy(oxo)methyl]-2,6-dimethyl-1-(4-nitrophenyl)-4H-pyridine-3-carboxylic acid IUPAC Name: 5-(2-acetamidoethoxycarbonyl)-2,6-dimethyl-1-(4-nitrophenyl)-4H-pyridine-3-carboxylic acid Traditional Name: 5-(2-acetamidoethoxycarbonyl)-2,6-dimethyl-1-(4-nitrophenyl)-4H-pyridine-3-carboxylic acid Formula: C19H21N3O7 MolecularWeight: 403.38594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(=C(N1C2=CC=C(C=C2)[N+](=O)[O-])C)C(=O)OCCNC(=O)C)C(=O)O

Isomeric SMILES

CC1=C(CC(=C(N1C2=CC=C(C=C2)[N+](=O)[O-])C)C(=O)OCCNC(=O)C)C(=O)O

InChI

InChI=1S/C19H21N3O7/c1-11-16(18(24)25)10-17(19(26)29-9-8-20-13(3)23)12(2)21(11)14-4-6-15(7-5-14)22(27)28/h4-7H,8-10H2,1-3H3,(H,20,23)(H,24,25)