methyl (2S)-2-[3-[(3-chlorophenyl)sulfonylamino]propanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[3-[(3-chlorophenyl)sulfonylamino]propanoylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[3-[(3-chlorophenyl)sulfonylamino]propanoylamino]-3-phenyl-propanoate CAS Name: (2S)-2-[[3-[(3-chlorophenyl)sulfonylamino]-1-oxopropyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[3-[(3-chlorophenyl)sulfonylamino]propanoylamino]-3-phenylpropanoate Traditional Name: (2S)-2-[3-[(3-chlorophenyl)sulfonylamino]propanoylamino]-3-phenyl-propionic acid methyl ester Formula: C19H21ClN2O5S MolecularWeight: 424.89844

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)CCNS(=O)(=O)C2=CC(=CC=C2)Cl

Isomeric SMILES

COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CCNS(=O)(=O)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C19H21ClN2O5S/c1-27-19(24)17(12-14-6-3-2-4-7-14)22-18(23)10-11-21-28(25,26)16-9-5-8-15(20)13-16/h2-9,13,17,21H,10-12H2,1H3,(H,22,23)/t17-/m0/s1