methyl 2-[2-[methyl-(3-methyl-4-propan-2-yloxy-phenyl)sulfonyl-amino]ethanoylamino]benzoate

Systemtic Name: methyl 2-[2-[methyl-(3-methyl-4-propan-2-yloxy-phenyl)sulfonyl-amino]ethanoylamino]benzoate Openeye Name: methyl 2-[[2-[(4-isopropoxy-3-methyl-phenyl)sulfonyl-methyl-amino]acetyl]amino]benzoate CAS Name: 2-[[2-[methyl-(3-methyl-4-propan-2-yloxyphenyl)sulfonylamino]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-[methyl-(3-methyl-4-propan-2-yloxyphenyl)sulfonylamino]acetyl]amino]benzoate Traditional Name: 2-[[2-[(4-isopropoxy-3-methyl-phenyl)sulfonyl-methyl-amino]acetyl]amino]benzoic acid methyl ester Formula: C21H26N2O6S MolecularWeight: 434.50594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N(C)CC(=O)NC2=CC=CC=C2C(=O)OC)OC(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N(C)CC(=O)NC2=CC=CC=C2C(=O)OC)OC(C)C

InChI

InChI=1S/C21H26N2O6S/c1-14(2)29-19-11-10-16(12-15(19)3)30(26,27)23(4)13-20(24)22-18-9-7-6-8-17(18)21(25)28-5/h6-12,14H,13H2,1-5H3,(H,22,24)