2-azanylethyl 2,6-dimethyl-4-(2-methylphenyl)-5-nitro-1,4-dihydropyridine-3-carboxylate

Systemtic Name: 2-azanylethyl 2,6-dimethyl-4-(2-methylphenyl)-5-nitro-1,4-dihydropyridine-3-carboxylate Openeye Name: 2-aminoethyl 2,6-dimethyl-5-nitro-4-(o-tolyl)-1,4-dihydropyridine-3-carboxylate CAS Name: 2,6-dimethyl-4-(2-methylphenyl)-5-nitro-1,4-dihydropyridine-3-carboxylic acid 2-aminoethyl ester IUPAC Name: 2-aminoethyl 2,6-dimethyl-4-(2-methylphenyl)-5-nitro-1,4-dihydropyridine-3-carboxylate Traditional Name: 2,6-dimethyl-5-nitro-4-(o-tolyl)-1,4-dihydropyridine-3-carboxylic acid 2-aminoethyl ester Formula: C17H21N3O4 MolecularWeight: 331.36634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2C(=C(NC(=C2[N+](=O)[O-])C)C)C(=O)OCCN

Isomeric SMILES

CC1=CC=CC=C1C2C(=C(NC(=C2[N+](=O)[O-])C)C)C(=O)OCCN

InChI

InChI=1S/C17H21N3O4/c1-10-6-4-5-7-13(10)15-14(17(21)24-9-8-18)11(2)19-12(3)16(15)20(22)23/h4-7,15,19H,8-9,18H2,1-3H3