ethyl 4-[1-(3-chloranyl-2-piperidin-1-yl-phenyl)-2-(ethylamino)-2-oxidanylidene-ethyl]benzoate

Systemtic Name: ethyl 4-[1-(3-chloranyl-2-piperidin-1-yl-phenyl)-2-(ethylamino)-2-oxidanylidene-ethyl]benzoate Openeye Name: ethyl 4-[1-[3-chloro-2-(1-piperidyl)phenyl]-2-(ethylamino)-2-oxo-ethyl]benzoate CAS Name: 4-[1-[3-chloro-2-(1-piperidinyl)phenyl]-2-(ethylamino)-2-oxoethyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[1-(3-chloro-2-piperidin-1-ylphenyl)-2-(ethylamino)-2-oxoethyl]benzoate Traditional Name: 4-[1-(3-chloro-2-piperidino-phenyl)-2-(ethylamino)-2-keto-ethyl]benzoic acid ethyl ester Formula: C24H29ClN2O3 MolecularWeight: 428.95166

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C1=CC=C(C=C1)C(=O)OCC)C2=C(C(=CC=C2)Cl)N3CCCCC3

Isomeric SMILES

CCNC(=O)C(C1=CC=C(C=C1)C(=O)OCC)C2=C(C(=CC=C2)Cl)N3CCCCC3

InChI

InChI=1S/C24H29ClN2O3/c1-3-26-23(28)21(17-11-13-18(14-12-17)24(29)30-4-2)19-9-8-10-20(25)22(19)27-15-6-5-7-16-27/h8-14,21H,3-7,15-16H2,1-2H3,(H,26,28)