O1-ethyl O4-methyl (2S,3S)-2-[(4-methoxyphenyl)amino]-3-propan-2-yl-butanedioate

Systemtic Name: O1-ethyl O4-methyl (2S,3S)-2-[(4-methoxyphenyl)amino]-3-propan-2-yl-butanedioate Openeye Name: O1-ethyl O4-methyl (2S,3S)-3-isopropyl-2-(4-methoxyanilino)butanedioate CAS Name: (2S,3S)-2-(4-methoxyanilino)-3-propan-2-ylbutanedioic acid O1-ethyl ester O4-methyl ester IUPAC Name: 1-O-ethyl 4-O-methyl (2S,3S)-2-(4-methoxyanilino)-3-propan-2-ylbutanedioate Traditional Name: (2S,3S)-3-isopropyl-2-(p-anisidino)succinic acid O1-ethyl ester O4-methyl ester Formula: C17H25NO5 MolecularWeight: 323.3841

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)[C@H]([C@H](C(C)C)C(=O)OC)NC1=CC=C(C=C1)OC

InChI

InChI=1S/C17H25NO5/c1-6-23-17(20)15(14(11(2)3)16(19)22-5)18-12-7-9-13(21-4)10-8-12/h7-11,14-15,18H,6H2,1-5H3/t14-,15-/m0/s1