4-oxidanylidene-3-[[(2S)-4-oxidanylidene-4-(phenethylamino)-2-propan-2-yl-butanoyl]amino]butanoic acid

Systemtic Name: 4-oxidanylidene-3-[[(2S)-4-oxidanylidene-4-(phenethylamino)-2-propan-2-yl-butanoyl]amino]butanoic acid Openeye Name: 3-[[(2S)-2-isopropyl-4-oxo-4-(phenethylamino)butanoyl]amino]-4-oxo-butanoic acid CAS Name: 3-[[(2S)-1,4-dioxo-4-(phenethylamino)-2-propan-2-ylbutyl]amino]-4-oxobutanoic acid IUPAC Name: 4-oxo-3-[[(2S)-4-oxo-4-(phenethylamino)-2-propan-2-ylbutanoyl]amino]butanoic acid Traditional Name: 3-[[(2S)-2-isopropyl-4-keto-4-(phenethylamino)butanoyl]amino]-4-keto-butyric acid Formula: C19H26N2O5 MolecularWeight: 362.42014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC(=O)NCCC1=CC=CC=C1)C(=O)NC(CC(=O)O)C=O

Isomeric SMILES

CC(C)[C@H](CC(=O)NCCC1=CC=CC=C1)C(=O)NC(CC(=O)O)C=O

InChI

InChI=1S/C19H26N2O5/c1-13(2)16(19(26)21-15(12-22)10-18(24)25)11-17(23)20-9-8-14-6-4-3-5-7-14/h3-7,12-13,15-16H,8-11H2,1-2H3,(H,20,23)(H,21,26)(H,24,25)/t15?,16-/m0/s1