methyl 4-[3-[3-[(3-chloranyl-4-methoxy-phenyl)amino]-3-oxidanylidene-propyl]piperidin-1-yl]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[3-[3-[(3-chloranyl-4-methoxy-phenyl)amino]-3-oxidanylidene-propyl]piperidin-1-yl]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[3-[3-(3-chloro-4-methoxy-anilino)-3-oxo-propyl]-1-piperidyl]-4-oxo-butanoate CAS Name: 4-[3-[3-(3-chloro-4-methoxyanilino)-3-oxopropyl]-1-piperidinyl]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[3-[3-(3-chloro-4-methoxyanilino)-3-oxopropyl]piperidin-1-yl]-4-oxobutanoate Traditional Name: 4-[3-[3-(3-chloro-4-methoxy-anilino)-3-keto-propyl]piperidino]-4-keto-butyric acid methyl ester Formula: C20H27ClN2O5 MolecularWeight: 410.89178

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CCC2CCCN(C2)C(=O)CCC(=O)OC)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CCC2CCCN(C2)C(=O)CCC(=O)OC)Cl

InChI

InChI=1S/C20H27ClN2O5/c1-27-17-7-6-15(12-16(17)21)22-18(24)8-5-14-4-3-11-23(13-14)19(25)9-10-20(26)28-2/h6-7,12,14H,3-5,8-11,13H2,1-2H3,(H,22,24)