1-(2,6-dimethylphenyl)ethyl 2-methyl-5-(2-piperidin-1-ylethyl)-1H-indole-3-carboxylate

Systemtic Name: 1-(2,6-dimethylphenyl)ethyl 2-methyl-5-(2-piperidin-1-ylethyl)-1H-indole-3-carboxylate Openeye Name: 1-(2,6-dimethylphenyl)ethyl 2-methyl-5-[2-(1-piperidyl)ethyl]-1H-indole-3-carboxylate CAS Name: 2-methyl-5-[2-(1-piperidinyl)ethyl]-1H-indole-3-carboxylic acid 1-(2,6-dimethylphenyl)ethyl ester IUPAC Name: 1-(2,6-dimethylphenyl)ethyl 2-methyl-5-(2-piperidin-1-ylethyl)-1H-indole-3-carboxylate Traditional Name: 2-methyl-5-(2-piperidinoethyl)-1H-indole-3-carboxylic acid 1-(2,6-dimethylphenyl)ethyl ester Formula: C27H34N2O2 MolecularWeight: 418.57106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)C(C)OC(=O)C2=C(NC3=C2C=C(C=C3)CCN4CCCCC4)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)C(C)OC(=O)C2=C(NC3=C2C=C(C=C3)CCN4CCCCC4)C

InChI

InChI=1S/C27H34N2O2/c1-18-9-8-10-19(2)25(18)21(4)31-27(30)26-20(3)28-24-12-11-22(17-23(24)26)13-16-29-14-6-5-7-15-29/h8-12,17,21,28H,5-7,13-16H2,1-4H3