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

Systemtic Name: ethyl 4-[2-[(2-methoxy-5-propan-2-yl-phenyl)sulfonyl-methyl-amino]ethanoylamino]benzoate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C22H28N2O6S MolecularWeight: 448.53252

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN(C)S(=O)(=O)C2=C(C=CC(=C2)C(C)C)OC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN(C)S(=O)(=O)C2=C(C=CC(=C2)C(C)C)OC

InChI

InChI=1S/C22H28N2O6S/c1-6-30-22(26)16-7-10-18(11-8-16)23-21(25)14-24(4)31(27,28)20-13-17(15(2)3)9-12-19(20)29-5/h7-13,15H,6,14H2,1-5H3,(H,23,25)