3-azanyl-4-[3,3-dimethylbutyl-(1-methoxy-1-oxidanylidene-3-phenyl-propan-2-yl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-azanyl-4-[3,3-dimethylbutyl-(1-methoxy-1-oxidanylidene-3-phenyl-propan-2-yl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 3-amino-4-[(1-benzyl-2-methoxy-2-oxo-ethyl)-(3,3-dimethylbutyl)amino]-4-oxo-butanoic acid CAS Name: 3-amino-4-[3,3-dimethylbutyl-(1-methoxy-1-oxo-3-phenylpropan-2-yl)amino]-4-oxobutanoic acid IUPAC Name: 3-amino-4-[3,3-dimethylbutyl-(1-methoxy-1-oxo-3-phenylpropan-2-yl)amino]-4-oxobutanoic acid Traditional Name: 3-amino-4-[(1-benzyl-2-keto-2-methoxy-ethyl)-(3,3-dimethylbutyl)amino]-4-keto-butyric acid Formula: C20H30N2O5 MolecularWeight: 378.4626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CCN(C(CC1=CC=CC=C1)C(=O)OC)C(=O)C(CC(=O)O)N

Isomeric SMILES

CC(C)(C)CCN(C(CC1=CC=CC=C1)C(=O)OC)C(=O)C(CC(=O)O)N

InChI

InChI=1S/C20H30N2O5/c1-20(2,3)10-11-22(18(25)15(21)13-17(23)24)16(19(26)27-4)12-14-8-6-5-7-9-14/h5-9,15-16H,10-13,21H2,1-4H3,(H,23,24)