[2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 5-(cyclohexylamino)-5-oxidanylidene-pentanoate

Systemtic Name: [2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 5-(cyclohexylamino)-5-oxidanylidene-pentanoate Openeye Name: [2-(3-chloro-2-methyl-anilino)-2-oxo-ethyl] 5-(cyclohexylamino)-5-oxo-pentanoate CAS Name: 5-(cyclohexylamino)-5-oxopentanoic acid [2-(3-chloro-2-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-chloro-2-methylanilino)-2-oxoethyl] 5-(cyclohexylamino)-5-oxopentanoate Traditional Name: 5-(cyclohexylamino)-5-keto-valeric acid [2-(3-chloro-2-methyl-anilino)-2-keto-ethyl] ester Formula: C20H27ClN2O4 MolecularWeight: 394.89238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)COC(=O)CCCC(=O)NC2CCCCC2

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)COC(=O)CCCC(=O)NC2CCCCC2

InChI

InChI=1S/C20H27ClN2O4/c1-14-16(21)9-5-10-17(14)23-19(25)13-27-20(26)12-6-11-18(24)22-15-7-3-2-4-8-15/h5,9-10,15H,2-4,6-8,11-13H2,1H3,(H,22,24)(H,23,25)