methyl 2-[(4-aminophenyl)methylsulfonyl-cyclohexyl-amino]propanoate

Systemtic Name: methyl 2-[(4-aminophenyl)methylsulfonyl-cyclohexyl-amino]propanoate Openeye Name: methyl 2-[(4-aminophenyl)methylsulfonyl-cyclohexyl-amino]propanoate CAS Name: 2-[(4-aminophenyl)methylsulfonyl-cyclohexylamino]propanoic acid methyl ester IUPAC Name: methyl 2-[(4-aminophenyl)methylsulfonyl-cyclohexylamino]propanoate Traditional Name: 2-[(4-aminobenzyl)sulfonyl-cyclohexyl-amino]propionic acid methyl ester Formula: C17H26N2O4S MolecularWeight: 354.46434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)N(C1CCCCC1)S(=O)(=O)CC2=CC=C(C=C2)N

Isomeric SMILES

CC(C(=O)OC)N(C1CCCCC1)S(=O)(=O)CC2=CC=C(C=C2)N

InChI

InChI=1S/C17H26N2O4S/c1-13(17(20)23-2)19(16-6-4-3-5-7-16)24(21,22)12-14-8-10-15(18)11-9-14/h8-11,13,16H,3-7,12,18H2,1-2H3