methyl 3-[5-azanyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-pentyl]benzoate

Systemtic Name: methyl 3-[5-azanyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-pentyl]benzoate Openeye Name: methyl 3-[5-amino-4-(tert-butoxycarbonylamino)-5-oxo-pentyl]benzoate CAS Name: 3-[5-amino-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-oxopentyl]benzoic acid methyl ester IUPAC Name: methyl 3-[5-amino-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxopentyl]benzoate Traditional Name: 3-[5-amino-4-(tert-butoxycarbonylamino)-5-keto-pentyl]benzoic acid methyl ester Formula: C18H26N2O5 MolecularWeight: 350.40944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCCC1=CC=CC(=C1)C(=O)OC)C(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)NC(CCCC1=CC=CC(=C1)C(=O)OC)C(=O)N

InChI

InChI=1S/C18H26N2O5/c1-18(2,3)25-17(23)20-14(15(19)21)10-6-8-12-7-5-9-13(11-12)16(22)24-4/h5,7,9,11,14H,6,8,10H2,1-4H3,(H2,19,21)(H,20,23)