methyl 6-[[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]carbamoylamino]hexanoate

Systemtic Name: methyl 6-[[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]carbamoylamino]hexanoate Openeye Name: methyl 6-[[1-(4-acetamidophenyl)sulfonyl-4-piperidyl]carbamoylamino]hexanoate CAS Name: 6-[[[[1-(4-acetamidophenyl)sulfonyl-4-piperidinyl]amino]-oxomethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]carbamoylamino]hexanoate Traditional Name: 6-[[1-(4-acetamidophenyl)sulfonyl-4-piperidyl]carbamoylamino]hexanoic acid methyl ester Formula: C21H32N4O6S MolecularWeight: 468.56698

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC(=O)NCCCCCC(=O)OC

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC(=O)NCCCCCC(=O)OC

InChI

InChI=1S/C21H32N4O6S/c1-16(26)23-17-7-9-19(10-8-17)32(29,30)25-14-11-18(12-15-25)24-21(28)22-13-5-3-4-6-20(27)31-2/h7-10,18H,3-6,11-15H2,1-2H3,(H,23,26)(H2,22,24,28)