2-[cyclohexylmethyl-[(2-methylpropan-2-yl)oxycarbonylamino]amino]-2-(4-methoxyphenyl)ethanoic acid

Systemtic Name: 2-[cyclohexylmethyl-[(2-methylpropan-2-yl)oxycarbonylamino]amino]-2-(4-methoxyphenyl)ethanoic acid Openeye Name: 2-[(tert-butoxycarbonylamino)-(cyclohexylmethyl)amino]-2-(4-methoxyphenyl)acetic acid CAS Name: 2-[cyclohexylmethyl-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]amino]-2-(4-methoxyphenyl)acetic acid IUPAC Name: 2-[cyclohexylmethyl-[(2-methylpropan-2-yl)oxycarbonylamino]amino]-2-(4-methoxyphenyl)acetic acid Traditional Name: 2-[(tert-butoxycarbonylamino)-(cyclohexylmethyl)amino]-2-(4-methoxyphenyl)acetic acid Formula: C21H32N2O5 MolecularWeight: 392.48918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NN(CC1CCCCC1)C(C2=CC=C(C=C2)OC)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NN(CC1CCCCC1)C(C2=CC=C(C=C2)OC)C(=O)O

InChI

InChI=1S/C21H32N2O5/c1-21(2,3)28-20(26)22-23(14-15-8-6-5-7-9-15)18(19(24)25)16-10-12-17(27-4)13-11-16/h10-13,15,18H,5-9,14H2,1-4H3,(H,22,26)(H,24,25)