6-azanyl-4-(3-bromophenyl)-2-(4-chlorophenyl)-5-cyano-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 6-azanyl-4-(3-bromophenyl)-2-(4-chlorophenyl)-5-cyano-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 6-amino-4-(3-bromophenyl)-2-(4-chlorophenyl)-5-cyano-1,4-dihydropyridine-3-carboxylic acid CAS Name: 6-amino-4-(3-bromophenyl)-2-(4-chlorophenyl)-5-cyano-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 6-amino-4-(3-bromophenyl)-2-(4-chlorophenyl)-5-cyano-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 6-amino-4-(3-bromophenyl)-2-(4-chlorophenyl)-5-cyano-1,4-dihydropyridine-3-carboxylic acid Formula: C19H13BrClN3O2 MolecularWeight: 430.68242

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C2C(=C(NC(=C2C(=O)O)C3=CC=C(C=C3)Cl)N)C#N

Isomeric SMILES

C1=CC(=CC(=C1)Br)C2C(=C(NC(=C2C(=O)O)C3=CC=C(C=C3)Cl)N)C#N

InChI

InChI=1S/C19H13BrClN3O2/c20-12-3-1-2-11(8-12)15-14(9-22)18(23)24-17(16(15)19(25)26)10-4-6-13(21)7-5-10/h1-8,15,24H,23H2,(H,25,26)