propan-2-yl 4-[4-[(4-methoxyphenyl)sulfonyl-methyl-amino]butanoylamino]benzoate

Systemtic Name: propan-2-yl 4-[4-[(4-methoxyphenyl)sulfonyl-methyl-amino]butanoylamino]benzoate Openeye Name: isopropyl 4-[4-[(4-methoxyphenyl)sulfonyl-methyl-amino]butanoylamino]benzoate CAS Name: 4-[[4-[(4-methoxyphenyl)sulfonyl-methylamino]-1-oxobutyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[4-[(4-methoxyphenyl)sulfonyl-methylamino]butanoylamino]benzoate Traditional Name: 4-[4-[(4-methoxyphenyl)sulfonyl-methyl-amino]butanoylamino]benzoic acid isopropyl ester Formula: C22H28N2O6S MolecularWeight: 448.53252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)CCCN(C)S(=O)(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)CCCN(C)S(=O)(=O)C2=CC=C(C=C2)OC

InChI

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