2,6-dimethyl-4-(3-nitrophenyl)-5-(1-phenylprop-2-ynoxycarbonyl)-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 2,6-dimethyl-4-(3-nitrophenyl)-5-(1-phenylprop-2-ynoxycarbonyl)-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 2,6-dimethyl-4-(3-nitrophenyl)-5-(1-phenylprop-2-ynoxycarbonyl)-1,4-dihydropyridine-3-carboxylic acid CAS Name: 2,6-dimethyl-4-(3-nitrophenyl)-5-[oxo(1-phenylprop-2-ynoxy)methyl]-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 2,6-dimethyl-4-(3-nitrophenyl)-5-(1-phenylprop-2-ynoxycarbonyl)-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 2,6-dimethyl-4-(3-nitrophenyl)-5-(1-phenylprop-2-ynoxycarbonyl)-1,4-dihydropyridine-3-carboxylic acid Formula: C24H20N2O6 MolecularWeight: 432.4254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OC(C#C)C2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OC(C#C)C2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C24H20N2O6/c1-4-19(16-9-6-5-7-10-16)32-24(29)21-15(3)25-14(2)20(23(27)28)22(21)17-11-8-12-18(13-17)26(30)31/h1,5-13,19,22,25H,2-3H3,(H,27,28)