methyl 4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoylamino]-3-oxidanyl-4-phenyl-butanoate

Systemtic Name: methyl 4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoylamino]-3-oxidanyl-4-phenyl-butanoate Openeye Name: methyl 4-[2-(tert-butoxycarbonylamino)hexanoylamino]-3-hydroxy-4-phenyl-butanoate CAS Name: 3-hydroxy-4-[[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxohexyl]amino]-4-phenylbutanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoylamino]-4-phenylbutanoate Traditional Name: 4-[2-(tert-butoxycarbonylamino)hexanoylamino]-3-hydroxy-4-phenyl-butyric acid methyl ester Formula: C22H34N2O6 MolecularWeight: 422.51516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)NC(C1=CC=CC=C1)C(CC(=O)OC)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCC(C(=O)NC(C1=CC=CC=C1)C(CC(=O)OC)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C22H34N2O6/c1-6-7-13-16(23-21(28)30-22(2,3)4)20(27)24-19(15-11-9-8-10-12-15)17(25)14-18(26)29-5/h8-12,16-17,19,25H,6-7,13-14H2,1-5H3,(H,23,28)(H,24,27)