(E)-3-[(4-methanoylphenyl)amino]-4,7-bis(oxidanyl)oct-5-enoic acid

Systemtic Name: (E)-3-[(4-methanoylphenyl)amino]-4,7-bis(oxidanyl)oct-5-enoic acid Openeye Name: (E)-3-(4-formylanilino)-4,7-dihydroxy-oct-5-enoic acid CAS Name: (E)-3-(4-formylanilino)-4,7-dihydroxy-5-octenoic acid IUPAC Name: (E)-3-(4-formylanilino)-4,7-dihydroxyoct-5-enoic acid Traditional Name: (E)-3-(4-formylanilino)-4,7-dihydroxy-oct-5-enoic acid Formula: C15H19NO5 MolecularWeight: 293.31506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=CC(C(CC(=O)O)NC1=CC=C(C=C1)C=O)O)O

Isomeric SMILES

CC(/C=C/C(C(CC(=O)O)NC1=CC=C(C=C1)C=O)O)O

InChI

InChI=1S/C15H19NO5/c1-10(18)2-7-14(19)13(8-15(20)21)16-12-5-3-11(9-17)4-6-12/h2-7,9-10,13-14,16,18-19H,8H2,1H3,(H,20,21)/b7-2+