ethyl 4-[[(2S)-2-[(3-chlorophenyl)sulfonylamino]-3-methyl-butanoyl]amino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[(2S)-2-[(3-chlorophenyl)sulfonylamino]-3-methyl-butanoyl]amino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[(2S)-2-[(3-chlorophenyl)sulfonylamino]-3-methyl-butanoyl]amino]piperidine-1-carboxylate CAS Name: 4-[[(2S)-2-[(3-chlorophenyl)sulfonylamino]-3-methyl-1-oxobutyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[(2S)-2-[(3-chlorophenyl)sulfonylamino]-3-methylbutanoyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[(2S)-2-[(3-chlorophenyl)sulfonylamino]-3-methyl-butanoyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C19H28ClN3O5S MolecularWeight: 445.96072

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C(C(C)C)NS(=O)(=O)C2=CC(=CC=C2)Cl

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)[C@H](C(C)C)NS(=O)(=O)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C19H28ClN3O5S/c1-4-28-19(25)23-10-8-15(9-11-23)21-18(24)17(13(2)3)22-29(26,27)16-7-5-6-14(20)12-16/h5-7,12-13,15,17,22H,4,8-11H2,1-3H3,(H,21,24)/t17-/m0/s1