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

Systemtic Name: (3S)-3-(2-azanylpropanoylamino)-4-[[(2S)-1-methoxy-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: (3S)-3-(2-aminopropanoylamino)-4-[[(1S)-1-benzyl-2-methoxy-2-oxo-ethyl]amino]-4-oxo-butanoic acid CAS Name: (3S)-3-[(2-amino-1-oxopropyl)amino]-4-[[(2S)-1-methoxy-1-oxo-3-phenylpropan-2-yl]amino]-4-oxobutanoic acid IUPAC Name: (3S)-3-(2-aminopropanoylamino)-4-[[(2S)-1-methoxy-1-oxo-3-phenylpropan-2-yl]amino]-4-oxobutanoic acid Traditional Name: (3S)-3-(alanylamino)-4-[[(1S)-1-benzyl-2-keto-2-methoxy-ethyl]amino]-4-keto-butyric acid Formula: C17H23N3O6 MolecularWeight: 365.38102

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)OC)N

InChI

InChI=1S/C17H23N3O6/c1-10(18)15(23)19-12(9-14(21)22)16(24)20-13(17(25)26-2)8-11-6-4-3-5-7-11/h3-7,10,12-13H,8-9,18H2,1-2H3,(H,19,23)(H,20,24)(H,21,22)/t10?,12-,13-/m0/s1