2-(aminomethyl)-4-(4-chloranyl-2-nitro-phenyl)-6-methyl-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 2-(aminomethyl)-4-(4-chloranyl-2-nitro-phenyl)-6-methyl-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 2-(aminomethyl)-4-(4-chloro-2-nitro-phenyl)-6-methyl-1,4-dihydropyridine-3-carboxylic acid CAS Name: 2-(aminomethyl)-4-(4-chloro-2-nitrophenyl)-6-methyl-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 2-(aminomethyl)-4-(4-chloro-2-nitrophenyl)-6-methyl-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 2-(aminomethyl)-4-(4-chloro-2-nitro-phenyl)-6-methyl-1,4-dihydropyridine-3-carboxylic acid Formula: C14H14ClN3O4 MolecularWeight: 323.73166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(C(=C(N1)CN)C(=O)O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(C(=C(N1)CN)C(=O)O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H14ClN3O4/c1-7-4-10(13(14(19)20)11(6-16)17-7)9-3-2-8(15)5-12(9)18(21)22/h2-5,10,17H,6,16H2,1H3,(H,19,20)