methyl 3-[[(2S)-2-[(3-chlorophenyl)sulfonylamino]propanoyl]amino]-4-methyl-benzoate

Systemtic Name: methyl 3-[[(2S)-2-[(3-chlorophenyl)sulfonylamino]propanoyl]amino]-4-methyl-benzoate Openeye Name: methyl 3-[[(2S)-2-[(3-chlorophenyl)sulfonylamino]propanoyl]amino]-4-methyl-benzoate CAS Name: 3-[[(2S)-2-[(3-chlorophenyl)sulfonylamino]-1-oxopropyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[(2S)-2-[(3-chlorophenyl)sulfonylamino]propanoyl]amino]-4-methylbenzoate Traditional Name: 3-[[(2S)-2-[(3-chlorophenyl)sulfonylamino]propanoyl]amino]-4-methyl-benzoic acid methyl ester Formula: C18H19ClN2O5S MolecularWeight: 410.87186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C(C)NS(=O)(=O)C2=CC(=CC=C2)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)[C@H](C)NS(=O)(=O)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C18H19ClN2O5S/c1-11-7-8-13(18(23)26-3)9-16(11)20-17(22)12(2)21-27(24,25)15-6-4-5-14(19)10-15/h4-10,12,21H,1-3H3,(H,20,22)/t12-/m0/s1