ethyl 4-[(2S)-2-[(2,4-dichlorophenyl)carbonylamino]-3-methyl-butanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(2S)-2-[(2,4-dichlorophenyl)carbonylamino]-3-methyl-butanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(2S)-2-[(2,4-dichlorobenzoyl)amino]-3-methyl-butanoyl]piperazine-1-carboxylate CAS Name: 4-[(2S)-2-[[(2,4-dichlorophenyl)-oxomethyl]amino]-3-methyl-1-oxobutyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2S)-2-[(2,4-dichlorobenzoyl)amino]-3-methylbutanoyl]piperazine-1-carboxylate Traditional Name: 4-[(2S)-2-[(2,4-dichlorobenzoyl)amino]-3-methyl-butanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C19H25Cl2N3O4 MolecularWeight: 430.3255

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C(C(C)C)NC(=O)C2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)[C@H](C(C)C)NC(=O)C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C19H25Cl2N3O4/c1-4-28-19(27)24-9-7-23(8-10-24)18(26)16(12(2)3)22-17(25)14-6-5-13(20)11-15(14)21/h5-6,11-12,16H,4,7-10H2,1-3H3,(H,22,25)/t16-/m0/s1