3-[2-(2-azanylpropanoylamino)propanoylamino]-4-oxidanylidene-4-[(1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]butanoic acid

Systemtic Name: 3-[2-(2-azanylpropanoylamino)propanoylamino]-4-oxidanylidene-4-[(1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]butanoic acid Openeye Name: 3-[2-(2-aminopropanoylamino)propanoylamino]-4-[(1-benzyl-2-hydroxy-2-oxo-ethyl)amino]-4-oxo-butanoic acid CAS Name: 3-[[2-[(2-amino-1-oxopropyl)amino]-1-oxopropyl]amino]-4-[(1-hydroxy-1-oxo-3-phenylpropan-2-yl)amino]-4-oxobutanoic acid IUPAC Name: 3-[2-(2-aminopropanoylamino)propanoylamino]-4-[(1-hydroxy-1-oxo-3-phenylpropan-2-yl)amino]-4-oxobutanoic acid Traditional Name: 3-[2-(alanylamino)propanoylamino]-4-[(1-benzyl-2-hydroxy-2-keto-ethyl)amino]-4-keto-butyric acid Formula: C19H26N4O7 MolecularWeight: 422.43234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C)C(=O)NC(CC(=O)O)C(=O)NC(CC1=CC=CC=C1)C(=O)O)N

Isomeric SMILES

CC(C(=O)NC(C)C(=O)NC(CC(=O)O)C(=O)NC(CC1=CC=CC=C1)C(=O)O)N

InChI

InChI=1S/C19H26N4O7/c1-10(20)16(26)21-11(2)17(27)22-13(9-15(24)25)18(28)23-14(19(29)30)8-12-6-4-3-5-7-12/h3-7,10-11,13-14H,8-9,20H2,1-2H3,(H,21,26)(H,22,27)(H,23,28)(H,24,25)(H,29,30)