diethyl (E)-2-[(4,4-dimethyl-3-oxidanyl-5-phenyl-pentyl)amino]non-4-enedioate

Systemtic Name: diethyl (E)-2-[(4,4-dimethyl-3-oxidanyl-5-phenyl-pentyl)amino]non-4-enedioate Openeye Name: diethyl (E)-2-[(3-hydroxy-4,4-dimethyl-5-phenyl-pentyl)amino]non-4-enedioate CAS Name: (E)-2-[(3-hydroxy-4,4-dimethyl-5-phenylpentyl)amino]-4-nonenedioic acid diethyl ester IUPAC Name: diethyl (E)-2-[(3-hydroxy-4,4-dimethyl-5-phenylpentyl)amino]non-4-enedioate Traditional Name: (E)-2-[(3-hydroxy-4,4-dimethyl-5-phenyl-pentyl)amino]non-4-enedioic acid diethyl ester Formula: C26H41NO5 MolecularWeight: 447.60744

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCC=CCC(C(=O)OCC)NCCC(C(C)(C)CC1=CC=CC=C1)O

Isomeric SMILES

CCOC(=O)CCC/C=C/CC(C(=O)OCC)NCCC(C(C)(C)CC1=CC=CC=C1)O

InChI

InChI=1S/C26H41NO5/c1-5-31-24(29)17-13-8-7-12-16-22(25(30)32-6-2)27-19-18-23(28)26(3,4)20-21-14-10-9-11-15-21/h7,9-12,14-15,22-23,27-28H,5-6,8,13,16-20H2,1-4H3/b12-7+