methyl 2-[2-[(3-chloranyl-4-methyl-phenyl)sulfonylamino]ethanoylamino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[2-[(3-chloranyl-4-methyl-phenyl)sulfonylamino]ethanoylamino]-4-methyl-pentanoate Openeye Name: methyl 2-[[2-[(3-chloro-4-methyl-phenyl)sulfonylamino]acetyl]amino]-4-methyl-pentanoate CAS Name: 2-[[2-[(3-chloro-4-methylphenyl)sulfonylamino]-1-oxoethyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[[2-[(3-chloro-4-methylphenyl)sulfonylamino]acetyl]amino]-4-methylpentanoate Traditional Name: 2-[[2-[(3-chloro-4-methyl-phenyl)sulfonylamino]acetyl]amino]-4-methyl-valeric acid methyl ester Formula: C16H23ClN2O5S MolecularWeight: 390.88222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCC(=O)NC(CC(C)C)C(=O)OC)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCC(=O)NC(CC(C)C)C(=O)OC)Cl

InChI

InChI=1S/C16H23ClN2O5S/c1-10(2)7-14(16(21)24-4)19-15(20)9-18-25(22,23)12-6-5-11(3)13(17)8-12/h5-6,8,10,14,18H,7,9H2,1-4H3,(H,19,20)