(E)-8-azanyl-2-[2-(4-methoxyphenyl)ethyl]-8-oxidanylidene-oct-3-enoic acid

Systemtic Name: (E)-8-azanyl-2-[2-(4-methoxyphenyl)ethyl]-8-oxidanylidene-oct-3-enoic acid Openeye Name: (E)-8-amino-2-[2-(4-methoxyphenyl)ethyl]-8-oxo-oct-3-enoic acid CAS Name: (E)-8-amino-2-[2-(4-methoxyphenyl)ethyl]-8-oxo-3-octenoic acid IUPAC Name: (E)-8-amino-2-[2-(4-methoxyphenyl)ethyl]-8-oxooct-3-enoic acid Traditional Name: (E)-8-amino-8-keto-2-[2-(4-methoxyphenyl)ethyl]oct-3-enoic acid Formula: C17H23NO4 MolecularWeight: 305.36882

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC(C=CCCCC(=O)N)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)CCC(/C=C/CCCC(=O)N)C(=O)O

InChI

InChI=1S/C17H23NO4/c1-22-15-11-8-13(9-12-15)7-10-14(17(20)21)5-3-2-4-6-16(18)19/h3,5,8-9,11-12,14H,2,4,6-7,10H2,1H3,(H2,18,19)(H,20,21)/b5-3+