methyl 2,6-dimethyl-4-(3-nitrophenyl)-5-(prop-2-ynoxycarbamoyl)-1,4-dihydropyridine-3-carboxylate

Systemtic Name: methyl 2,6-dimethyl-4-(3-nitrophenyl)-5-(prop-2-ynoxycarbamoyl)-1,4-dihydropyridine-3-carboxylate Openeye Name: methyl 2,6-dimethyl-4-(3-nitrophenyl)-5-(prop-2-ynoxycarbamoyl)-1,4-dihydropyridine-3-carboxylate CAS Name: 2,6-dimethyl-4-(3-nitrophenyl)-5-[oxo-(prop-2-ynoxyamino)methyl]-1,4-dihydropyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 2,6-dimethyl-4-(3-nitrophenyl)-5-(prop-2-ynoxycarbamoyl)-1,4-dihydropyridine-3-carboxylate Traditional Name: 2,6-dimethyl-4-(3-nitrophenyl)-5-(propargyloxycarbamoyl)-1,4-dihydropyridine-3-carboxylic acid methyl ester Formula: C19H19N3O6 MolecularWeight: 385.37066

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19N3O6/c1-5-9-28-21-18(23)15-11(2)20-12(3)16(19(24)27-4)17(15)13-7-6-8-14(10-13)22(25)26/h1,6-8,10,17,20H,9H2,2-4H3,(H,21,23)