methyl 4-[2-[(2-methoxy-5-propan-2-yl-phenyl)sulfonyl-methyl-amino]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[(2-methoxy-5-propan-2-yl-phenyl)sulfonyl-methyl-amino]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[(5-isopropyl-2-methoxy-phenyl)sulfonyl-methyl-amino]acetyl]amino]benzoate CAS Name: 4-[[2-[(2-methoxy-5-propan-2-ylphenyl)sulfonyl-methylamino]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[(2-methoxy-5-propan-2-ylphenyl)sulfonyl-methylamino]acetyl]amino]benzoate Traditional Name: 4-[[2-[(5-isopropyl-2-methoxy-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:

CC(C)C1=CC(=C(C=C1)OC)S(=O)(=O)N(C)CC(=O)NC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC(C)C1=CC(=C(C=C1)OC)S(=O)(=O)N(C)CC(=O)NC2=CC=C(C=C2)C(=O)OC

InChI

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