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

Systemtic Name: (2S,4R)-2-azanyl-4-[(E)-3-(2-methoxyphenyl)prop-2-enyl]pentanedioic acid Openeye Name: (2S,4R)-2-amino-4-[(E)-3-(2-methoxyphenyl)allyl]pentanedioic acid CAS Name: (2S,4R)-2-amino-4-[(E)-3-(2-methoxyphenyl)prop-2-enyl]pentanedioic acid IUPAC Name: (2S,4R)-2-amino-4-[(E)-3-(2-methoxyphenyl)prop-2-enyl]pentanedioic acid Traditional Name: (2S,4R)-2-amino-4-[(E)-3-(2-methoxyphenyl)allyl]glutaric acid Formula: C15H19NO5 MolecularWeight: 293.31506

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C=CCC(CC(C(=O)O)N)C(=O)O

Isomeric SMILES

COC1=CC=CC=C1/C=C/C[C@H](C[C@@H](C(=O)O)N)C(=O)O

InChI

InChI=1S/C15H19NO5/c1-21-13-8-3-2-5-10(13)6-4-7-11(14(17)18)9-12(16)15(19)20/h2-6,8,11-12H,7,9,16H2,1H3,(H,17,18)(H,19,20)/b6-4+/t11-,12+/m1/s1