O1,O1-diethyl O2-(phenylmethyl) (2R)-2-(1-methylindol-3-yl)ethane-1,1,2-tricarboxylate

Systemtic Name: O1,O1-diethyl O2-(phenylmethyl) (2R)-2-(1-methylindol-3-yl)ethane-1,1,2-tricarboxylate Openeye Name: O2-benzyl O1,O1-diethyl (2R)-2-(1-methylindol-3-yl)ethane-1,1,2-tricarboxylate CAS Name: (2R)-2-(1-methyl-3-indolyl)ethane-1,1,2-tricarboxylic acid O1,O1-diethyl ester O2-(phenylmethyl) ester IUPAC Name: 2-O-benzyl 1-O,1-O-diethyl (2R)-2-(1-methylindol-3-yl)ethane-1,1,2-tricarboxylate Traditional Name: (2R)-2-(1-methylindol-3-yl)ethane-1,1,2-tricarboxylic acid O2-benzyl ester O1,O1-diethyl ester Formula: C25H27NO6 MolecularWeight: 437.48498

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CN(C2=CC=CC=C21)C)C(=O)OCC3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C([C@H](C1=CN(C2=CC=CC=C21)C)C(=O)OCC3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C25H27NO6/c1-4-30-24(28)22(25(29)31-5-2)21(23(27)32-16-17-11-7-6-8-12-17)19-15-26(3)20-14-10-9-13-18(19)20/h6-15,21-22H,4-5,16H2,1-3H3/t21-/m0/s1