[2-[(4-bromanyl-2-chloranyl-phenyl)amino]-2-oxidanylidene-ethyl] 4-(cyclohexylamino)-4-oxidanylidene-butanoate

Systemtic Name: [2-[(4-bromanyl-2-chloranyl-phenyl)amino]-2-oxidanylidene-ethyl] 4-(cyclohexylamino)-4-oxidanylidene-butanoate Openeye Name: [2-(4-bromo-2-chloro-anilino)-2-oxo-ethyl] 4-(cyclohexylamino)-4-oxo-butanoate CAS Name: 4-(cyclohexylamino)-4-oxobutanoic acid [2-(4-bromo-2-chloroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromo-2-chloroanilino)-2-oxoethyl] 4-(cyclohexylamino)-4-oxobutanoate Traditional Name: 4-(cyclohexylamino)-4-keto-butyric acid [2-(4-bromo-2-chloro-anilino)-2-keto-ethyl] ester Formula: C18H22BrClN2O4 MolecularWeight: 445.73528

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CCC(=O)OCC(=O)NC2=C(C=C(C=C2)Br)Cl

Isomeric SMILES

C1CCC(CC1)NC(=O)CCC(=O)OCC(=O)NC2=C(C=C(C=C2)Br)Cl

InChI

InChI=1S/C18H22BrClN2O4/c19-12-6-7-15(14(20)10-12)22-17(24)11-26-18(25)9-8-16(23)21-13-4-2-1-3-5-13/h6-7,10,13H,1-5,8-9,11H2,(H,21,23)(H,22,24)