2-[[(E)-3-azanyl-2-oxidanyl-4-phenyl-but-2-enoyl]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[[(E)-3-azanyl-2-oxidanyl-4-phenyl-but-2-enoyl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[[(E)-3-amino-2-hydroxy-4-phenyl-but-2-enoyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[(E)-3-amino-2-hydroxy-1-oxo-4-phenylbut-2-enyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[(E)-3-amino-2-hydroxy-4-phenylbut-2-enoyl]amino]-4-methylpentanoic acid Traditional Name: 2-[[(E)-3-amino-2-hydroxy-4-phenyl-but-2-enoyl]amino]-4-methyl-valeric acid Formula: C16H22N2O4 MolecularWeight: 306.35688

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O4/c1-10(2)8-13(16(21)22)18-15(20)14(19)12(17)9-11-6-4-3-5-7-11/h3-7,10,13,19H,8-9,17H2,1-2H3,(H,18,20)(H,21,22)/b14-12+