ethyl 6-[4-[1-(2-chlorophenyl)-2-methoxy-2-oxidanylidene-ethyl]piperazin-1-yl]pyridine-3-carboxylate

Systemtic Name: ethyl 6-[4-[1-(2-chlorophenyl)-2-methoxy-2-oxidanylidene-ethyl]piperazin-1-yl]pyridine-3-carboxylate Openeye Name: ethyl 6-[4-[1-(2-chlorophenyl)-2-methoxy-2-oxo-ethyl]piperazin-1-yl]pyridine-3-carboxylate CAS Name: 6-[4-[1-(2-chlorophenyl)-2-methoxy-2-oxoethyl]-1-piperazinyl]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[4-[1-(2-chlorophenyl)-2-methoxy-2-oxoethyl]piperazin-1-yl]pyridine-3-carboxylate Traditional Name: 6-[4-[1-(2-chlorophenyl)-2-keto-2-methoxy-ethyl]piperazino]nicotinic acid ethyl ester Formula: C21H24ClN3O4 MolecularWeight: 417.88596

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(C=C1)N2CCN(CC2)C(C3=CC=CC=C3Cl)C(=O)OC

Isomeric SMILES

CCOC(=O)C1=CN=C(C=C1)N2CCN(CC2)C(C3=CC=CC=C3Cl)C(=O)OC

InChI

InChI=1S/C21H24ClN3O4/c1-3-29-20(26)15-8-9-18(23-14-15)24-10-12-25(13-11-24)19(21(27)28-2)16-6-4-5-7-17(16)22/h4-9,14,19H,3,10-13H2,1-2H3