2-cyanoethyl 5-aminocarbonyl-2,6-dimethyl-4-(4-nitrophenyl)-1,4-dihydropyridine-3-carboxylate

Systemtic Name: 2-cyanoethyl 5-aminocarbonyl-2,6-dimethyl-4-(4-nitrophenyl)-1,4-dihydropyridine-3-carboxylate Openeye Name: 2-cyanoethyl 5-carbamoyl-2,6-dimethyl-4-(4-nitrophenyl)-1,4-dihydropyridine-3-carboxylate CAS Name: 5-carbamoyl-2,6-dimethyl-4-(4-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid 2-cyanoethyl ester IUPAC Name: 2-cyanoethyl 5-carbamoyl-2,6-dimethyl-4-(4-nitrophenyl)-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-carbamoyl-2,6-dimethyl-4-(4-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid 2-cyanoethyl ester Formula: C18H18N4O5 MolecularWeight: 370.35932

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N4O5/c1-10-14(17(20)23)16(12-4-6-13(7-5-12)22(25)26)15(11(2)21-10)18(24)27-9-3-8-19/h4-7,16,21H,3,9H2,1-2H3,(H2,20,23)