1-(2,4-dimethylphenyl)ethyl 2-methyl-5-(2-piperidin-2-ylethyl)-1H-indole-3-carboxylate

Systemtic Name: 1-(2,4-dimethylphenyl)ethyl 2-methyl-5-(2-piperidin-2-ylethyl)-1H-indole-3-carboxylate Openeye Name: 1-(2,4-dimethylphenyl)ethyl 2-methyl-5-[2-(2-piperidyl)ethyl]-1H-indole-3-carboxylate CAS Name: 2-methyl-5-[2-(2-piperidinyl)ethyl]-1H-indole-3-carboxylic acid 1-(2,4-dimethylphenyl)ethyl ester IUPAC Name: 1-(2,4-dimethylphenyl)ethyl 2-methyl-5-(2-piperidin-2-ylethyl)-1H-indole-3-carboxylate Traditional Name: 2-methyl-5-[2-(2-piperidyl)ethyl]-1H-indole-3-carboxylic acid 1-(2,4-dimethylphenyl)ethyl ester Formula: C27H34N2O2 MolecularWeight: 418.57106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)OC(=O)C2=C(NC3=C2C=C(C=C3)CCC4CCCCN4)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)OC(=O)C2=C(NC3=C2C=C(C=C3)CCC4CCCCN4)C)C

InChI

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