ethyl 5-chloranyl-6-[4-[(3,4-dichlorophenyl)carbamoyl]piperazin-1-yl]pyridine-3-carboxylate

Systemtic Name: ethyl 5-chloranyl-6-[4-[(3,4-dichlorophenyl)carbamoyl]piperazin-1-yl]pyridine-3-carboxylate Openeye Name: ethyl 5-chloro-6-[4-[(3,4-dichlorophenyl)carbamoyl]piperazin-1-yl]pyridine-3-carboxylate CAS Name: 5-chloro-6-[4-[(3,4-dichloroanilino)-oxomethyl]-1-piperazinyl]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-chloro-6-[4-[(3,4-dichlorophenyl)carbamoyl]piperazin-1-yl]pyridine-3-carboxylate Traditional Name: 5-chloro-6-[4-[(3,4-dichlorophenyl)carbamoyl]piperazino]nicotinic acid ethyl ester Formula: C19H19Cl3N4O3 MolecularWeight: 457.73816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(N=C1)N2CCN(CC2)C(=O)NC3=CC(=C(C=C3)Cl)Cl)Cl

Isomeric SMILES

CCOC(=O)C1=CC(=C(N=C1)N2CCN(CC2)C(=O)NC3=CC(=C(C=C3)Cl)Cl)Cl

InChI

InChI=1S/C19H19Cl3N4O3/c1-2-29-18(27)12-9-16(22)17(23-11-12)25-5-7-26(8-6-25)19(28)24-13-3-4-14(20)15(21)10-13/h3-4,9-11H,2,5-8H2,1H3,(H,24,28)