(2S,4R)-2-azanyl-4-[(E)-3-(4-propan-2-ylphenyl)prop-2-enyl]pentanedioic acid

Systemtic Name: (2S,4R)-2-azanyl-4-[(E)-3-(4-propan-2-ylphenyl)prop-2-enyl]pentanedioic acid Openeye Name: (2S,4R)-2-amino-4-[(E)-3-(4-isopropylphenyl)allyl]pentanedioic acid CAS Name: (2S,4R)-2-amino-4-[(E)-3-(4-propan-2-ylphenyl)prop-2-enyl]pentanedioic acid IUPAC Name: (2S,4R)-2-amino-4-[(E)-3-(4-propan-2-ylphenyl)prop-2-enyl]pentanedioic acid Traditional Name: (2S,4R)-2-amino-4-[(E)-3-p-cumenylallyl]glutaric acid Formula: C17H23NO4 MolecularWeight: 305.36882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C=CCC(CC(C(=O)O)N)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C17H23NO4/c1-11(2)13-8-6-12(7-9-13)4-3-5-14(16(19)20)10-15(18)17(21)22/h3-4,6-9,11,14-15H,5,10,18H2,1-2H3,(H,19,20)(H,21,22)/b4-3+/t14-,15+/m1/s1