cyclohexylmethyl 6-(4-ethoxyphenyl)-3-methyl-4-oxidanylidene-1,5,6,7-tetrahydroindole-2-carboxylate

Systemtic Name: cyclohexylmethyl 6-(4-ethoxyphenyl)-3-methyl-4-oxidanylidene-1,5,6,7-tetrahydroindole-2-carboxylate Openeye Name: cyclohexylmethyl 6-(4-ethoxyphenyl)-3-methyl-4-oxo-1,5,6,7-tetrahydroindole-2-carboxylate CAS Name: 6-(4-ethoxyphenyl)-3-methyl-4-oxo-1,5,6,7-tetrahydroindole-2-carboxylic acid cyclohexylmethyl ester IUPAC Name: cyclohexylmethyl 6-(4-ethoxyphenyl)-3-methyl-4-oxo-1,5,6,7-tetrahydroindole-2-carboxylate Traditional Name: 4-keto-3-methyl-6-p-phenetyl-1,5,6,7-tetrahydroindole-2-carboxylic acid cyclohexylmethyl ester Formula: C25H31NO4 MolecularWeight: 409.51794

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2CC3=C(C(=C(N3)C(=O)OCC4CCCCC4)C)C(=O)C2

Isomeric SMILES

CCOC1=CC=C(C=C1)C2CC3=C(C(=C(N3)C(=O)OCC4CCCCC4)C)C(=O)C2

InChI

InChI=1S/C25H31NO4/c1-3-29-20-11-9-18(10-12-20)19-13-21-23(22(27)14-19)16(2)24(26-21)25(28)30-15-17-7-5-4-6-8-17/h9-12,17,19,26H,3-8,13-15H2,1-2H3