(E)-8-azanyl-2-[3-(methylamino)-3-oxidanylidene-2-phenyl-propyl]-8-oxidanylidene-oct-3-enoic acid

Systemtic Name: (E)-8-azanyl-2-[3-(methylamino)-3-oxidanylidene-2-phenyl-propyl]-8-oxidanylidene-oct-3-enoic acid Openeye Name: (E)-8-amino-2-[3-(methylamino)-3-oxo-2-phenyl-propyl]-8-oxo-oct-3-enoic acid CAS Name: (E)-8-amino-2-[3-(methylamino)-3-oxo-2-phenylpropyl]-8-oxo-3-octenoic acid IUPAC Name: (E)-8-amino-2-[3-(methylamino)-3-oxo-2-phenylpropyl]-8-oxooct-3-enoic acid Traditional Name: (E)-8-amino-8-keto-2-[3-keto-3-(methylamino)-2-phenyl-propyl]oct-3-enoic acid Formula: C18H24N2O4 MolecularWeight: 332.39416

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C(CC(C=CCCCC(=O)N)C(=O)O)C1=CC=CC=C1

Isomeric SMILES

CNC(=O)C(CC(/C=C/CCCC(=O)N)C(=O)O)C1=CC=CC=C1

InChI

InChI=1S/C18H24N2O4/c1-20-17(22)15(13-8-4-2-5-9-13)12-14(18(23)24)10-6-3-7-11-16(19)21/h2,4-6,8-10,14-15H,3,7,11-12H2,1H3,(H2,19,21)(H,20,22)(H,23,24)/b10-6+