methyl 4-[(2-methylpropan-2-yl)oxycarbonyl-(phenylmethyl)amino]cyclohexene-1-carboxylate

Systemtic Name: methyl 4-[(2-methylpropan-2-yl)oxycarbonyl-(phenylmethyl)amino]cyclohexene-1-carboxylate Openeye Name: methyl 4-[benzyl(tert-butoxycarbonyl)amino]cyclohexene-1-carboxylate CAS Name: 4-[[(2-methylpropan-2-yl)oxy-oxomethyl]-(phenylmethyl)amino]-1-cyclohexenecarboxylic acid methyl ester IUPAC Name: methyl 4-[benzyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]cyclohexene-1-carboxylate Traditional Name: 4-[benzyl(tert-butoxycarbonyl)amino]cyclohexene-1-carboxylic acid methyl ester Formula: C20H27NO4 MolecularWeight: 345.43268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CC1=CC=CC=C1)C2CCC(=CC2)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N(CC1=CC=CC=C1)C2CCC(=CC2)C(=O)OC

InChI

InChI=1S/C20H27NO4/c1-20(2,3)25-19(23)21(14-15-8-6-5-7-9-15)17-12-10-16(11-13-17)18(22)24-4/h5-10,17H,11-14H2,1-4H3