1-[(2R,4R)-4-ethoxycarbonyl-2-methyl-6-phenyl-hexanoyl]-2,3-dihydroindole-2-carboxylic acid

Systemtic Name: 1-[(2R,4R)-4-ethoxycarbonyl-2-methyl-6-phenyl-hexanoyl]-2,3-dihydroindole-2-carboxylic acid Openeye Name: 1-[(2R,4R)-4-ethoxycarbonyl-2-methyl-6-phenyl-hexanoyl]indoline-2-carboxylic acid CAS Name: 1-[(2R,4R)-4-ethoxycarbonyl-2-methyl-1-oxo-6-phenylhexyl]-2,3-dihydroindole-2-carboxylic acid IUPAC Name: 1-[(2R,4R)-4-ethoxycarbonyl-2-methyl-6-phenylhexanoyl]-2,3-dihydroindole-2-carboxylic acid Traditional Name: 1-[(2R,4R)-4-carbethoxy-2-methyl-6-phenyl-hexanoyl]indoline-2-carboxylic acid Formula: C25H29NO5 MolecularWeight: 423.50146

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=CC=C1)CC(C)C(=O)N2C(CC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CCOC(=O)[C@H](CCC1=CC=CC=C1)C[C@@H](C)C(=O)N2C(CC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C25H29NO5/c1-3-31-25(30)20(14-13-18-9-5-4-6-10-18)15-17(2)23(27)26-21-12-8-7-11-19(21)16-22(26)24(28)29/h4-12,17,20,22H,3,13-16H2,1-2H3,(H,28,29)/t17-,20-,22?/m1/s1