ethyl (6R)-6-(3,4-dimethoxyphenyl)-4-oxidanylidene-3-propyl-1,5,6,7-tetrahydroindole-2-carboxylate

Systemtic Name: ethyl (6R)-6-(3,4-dimethoxyphenyl)-4-oxidanylidene-3-propyl-1,5,6,7-tetrahydroindole-2-carboxylate Openeye Name: ethyl (6R)-6-(3,4-dimethoxyphenyl)-4-oxo-3-propyl-1,5,6,7-tetrahydroindole-2-carboxylate CAS Name: (6R)-6-(3,4-dimethoxyphenyl)-4-oxo-3-propyl-1,5,6,7-tetrahydroindole-2-carboxylic acid ethyl ester IUPAC Name: ethyl (6R)-6-(3,4-dimethoxyphenyl)-4-oxo-3-propyl-1,5,6,7-tetrahydroindole-2-carboxylate Traditional Name: (6R)-6-(3,4-dimethoxyphenyl)-4-keto-3-propyl-1,5,6,7-tetrahydroindole-2-carboxylic acid ethyl ester Formula: C22H27NO5 MolecularWeight: 385.45348

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(NC2=C1C(=O)CC(C2)C3=CC(=C(C=C3)OC)OC)C(=O)OCC

Isomeric SMILES

CCCC1=C(NC2=C1C(=O)C[C@@H](C2)C3=CC(=C(C=C3)OC)OC)C(=O)OCC

InChI

InChI=1S/C22H27NO5/c1-5-7-15-20-16(23-21(15)22(25)28-6-2)10-14(11-17(20)24)13-8-9-18(26-3)19(12-13)27-4/h8-9,12,14,23H,5-7,10-11H2,1-4H3/t14-/m1/s1