O4-[(1S,2R)-2-(dimethylamino)-1-phenyl-propyl] O1-ethyl (2S)-2-methyl-2-oxidanyl-butanedioate

Systemtic Name: O4-[(1S,2R)-2-(dimethylamino)-1-phenyl-propyl] O1-ethyl (2S)-2-methyl-2-oxidanyl-butanedioate Openeye Name: O4-[(1S,2R)-2-(dimethylamino)-1-phenyl-propyl] O1-ethyl (2S)-2-hydroxy-2-methyl-butanedioate CAS Name: (2S)-2-hydroxy-2-methylbutanedioic acid O4-[(1S,2R)-2-(dimethylamino)-1-phenylpropyl] ester O1-ethyl ester IUPAC Name: 4-O-[(1S,2R)-2-(dimethylamino)-1-phenylpropyl] 1-O-ethyl (2S)-2-hydroxy-2-methylbutanedioate Traditional Name: (2S)-2-hydroxy-2-methyl-succinic acid O4-[(1S,2R)-2-(dimethylamino)-1-phenyl-propyl] ester O1-ethyl ester Formula: C18H27NO5 MolecularWeight: 337.41068

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(CC(=O)OC(C1=CC=CC=C1)C(C)N(C)C)O

Isomeric SMILES

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

InChI

InChI=1S/C18H27NO5/c1-6-23-17(21)18(3,22)12-15(20)24-16(13(2)19(4)5)14-10-8-7-9-11-14/h7-11,13,16,22H,6,12H2,1-5H3/t13-,16-,18+/m1/s1