methyl 4-[2-[1-(5-chloranyl-2-pyrrolidin-1-yl-phenyl)ethylamino]-2-oxidanylidene-ethyl]benzoate

Systemtic Name: methyl 4-[2-[1-(5-chloranyl-2-pyrrolidin-1-yl-phenyl)ethylamino]-2-oxidanylidene-ethyl]benzoate Openeye Name: methyl 4-[2-[1-(5-chloro-2-pyrrolidin-1-yl-phenyl)ethylamino]-2-oxo-ethyl]benzoate CAS Name: 4-[2-[1-[5-chloro-2-(1-pyrrolidinyl)phenyl]ethylamino]-2-oxoethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[1-(5-chloro-2-pyrrolidin-1-ylphenyl)ethylamino]-2-oxoethyl]benzoate Traditional Name: 4-[2-[1-(5-chloro-2-pyrrolidino-phenyl)ethylamino]-2-keto-ethyl]benzoic acid methyl ester Formula: C22H25ClN2O3 MolecularWeight: 400.8985

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CC(=C1)Cl)N2CCCC2)NC(=O)CC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC(C1=C(C=CC(=C1)Cl)N2CCCC2)NC(=O)CC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H25ClN2O3/c1-15(19-14-18(23)9-10-20(19)25-11-3-4-12-25)24-21(26)13-16-5-7-17(8-6-16)22(27)28-2/h5-10,14-15H,3-4,11-13H2,1-2H3,(H,24,26)