methyl 4-methyl-3-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoylamino]benzoate Openeye Name: methyl 3-[4-(tert-butoxycarbonylamino)butanoylamino]-4-methyl-benzoate CAS Name: 4-methyl-3-[[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxobutyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoylamino]benzoate Traditional Name: 3-[4-(tert-butoxycarbonylamino)butanoylamino]-4-methyl-benzoic acid methyl ester Formula: C18H26N2O5 MolecularWeight: 350.40944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CCCNC(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CCCNC(=O)OC(C)(C)C

InChI

InChI=1S/C18H26N2O5/c1-12-8-9-13(16(22)24-5)11-14(12)20-15(21)7-6-10-19-17(23)25-18(2,3)4/h8-9,11H,6-7,10H2,1-5H3,(H,19,23)(H,20,21)