methyl 2-(2-cyclohexylethanoyl)-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate

Systemtic Name: methyl 2-(2-cyclohexylethanoyl)-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate Openeye Name: methyl 2-(2-cyclohexylacetyl)-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate CAS Name: 2-(2-cyclohexyl-1-oxoethyl)-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylic acid methyl ester IUPAC Name: methyl 2-(2-cyclohexylacetyl)-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate Traditional Name: 2-(2-cyclohexylacetyl)-1,3,4,5-tetrahydropyrid[4,3-b]indole-8-carboxylic acid methyl ester Formula: C21H26N2O3 MolecularWeight: 354.44274

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)NC3=C2CN(CC3)C(=O)CC4CCCCC4

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)NC3=C2CN(CC3)C(=O)CC4CCCCC4

InChI

InChI=1S/C21H26N2O3/c1-26-21(25)15-7-8-18-16(12-15)17-13-23(10-9-19(17)22-18)20(24)11-14-5-3-2-4-6-14/h7-8,12,14,22H,2-6,9-11,13H2,1H3