[1-[cyclohexyl(methyl)amino]-1-oxidanylidene-propan-2-yl] 2-[(4-ethanoylphenyl)sulfonylamino]propanoate

Systemtic Name: [1-[cyclohexyl(methyl)amino]-1-oxidanylidene-propan-2-yl] 2-[(4-ethanoylphenyl)sulfonylamino]propanoate Openeye Name: [2-[cyclohexyl(methyl)amino]-1-methyl-2-oxo-ethyl] 2-[(4-acetylphenyl)sulfonylamino]propanoate CAS Name: 2-[(4-acetylphenyl)sulfonylamino]propanoic acid [1-[cyclohexyl(methyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[cyclohexyl(methyl)amino]-1-oxopropan-2-yl] 2-[(4-acetylphenyl)sulfonylamino]propanoate Traditional Name: 2-[(4-acetylphenyl)sulfonylamino]propionic acid [2-[cyclohexyl(methyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C21H30N2O6S MolecularWeight: 438.5377

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC(C)C(=O)N(C)C1CCCCC1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)C

Isomeric SMILES

CC(C(=O)OC(C)C(=O)N(C)C1CCCCC1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)C

InChI

InChI=1S/C21H30N2O6S/c1-14(22-30(27,28)19-12-10-17(11-13-19)15(2)24)21(26)29-16(3)20(25)23(4)18-8-6-5-7-9-18/h10-14,16,18,22H,5-9H2,1-4H3