ethyl 2-[[4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]cyclohexyl]methyl-naphthalen-2-ylsulfonyl-amino]ethanoate

Systemtic Name: ethyl 2-[[4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]cyclohexyl]methyl-naphthalen-2-ylsulfonyl-amino]ethanoate Openeye Name: ethyl 2-[[4-[(tert-butoxycarbonylamino)methyl]cyclohexyl]methyl-(2-naphthylsulfonyl)amino]acetate CAS Name: 2-[[4-[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]cyclohexyl]methyl-(2-naphthalenylsulfonyl)amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]cyclohexyl]methyl-naphthalen-2-ylsulfonylamino]acetate Traditional Name: 2-[[4-[(tert-butoxycarbonylamino)methyl]cyclohexyl]methyl-(2-naphthylsulfonyl)amino]acetic acid ethyl ester Formula: C27H38N2O6S MolecularWeight: 518.66542

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(CC1CCC(CC1)CNC(=O)OC(C)(C)C)S(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CCOC(=O)CN(CC1CCC(CC1)CNC(=O)OC(C)(C)C)S(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C27H38N2O6S/c1-5-34-25(30)19-29(36(32,33)24-15-14-22-8-6-7-9-23(22)16-24)18-21-12-10-20(11-13-21)17-28-26(31)35-27(2,3)4/h6-9,14-16,20-21H,5,10-13,17-19H2,1-4H3,(H,28,31)