3-[2-(3-chlorophenyl)ethyl]-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridazine-5-carboxylic acid

Systemtic Name: 3-[2-(3-chlorophenyl)ethyl]-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridazine-5-carboxylic acid Openeye Name: 3-[2-(3-chlorophenyl)ethyl]-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridazine-5-carboxylic acid CAS Name: 3-[2-(3-chlorophenyl)ethyl]-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridazine-5-carboxylic acid IUPAC Name: 3-[2-(3-chlorophenyl)ethyl]-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridazine-5-carboxylic acid Traditional Name: 3-[2-(3-chlorophenyl)ethyl]-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridazine-5-carboxylic acid Formula: C20H18ClN3O4 MolecularWeight: 399.82762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=NN1)CCC2=CC(=CC=C2)Cl)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC1=C(C(C(=NN1)CCC2=CC(=CC=C2)Cl)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C20H18ClN3O4/c1-12-18(20(25)26)19(14-5-3-7-16(11-14)24(27)28)17(23-22-12)9-8-13-4-2-6-15(21)10-13/h2-7,10-11,19,22H,8-9H2,1H3,(H,25,26)