methyl 3-(methylaminomethyl)-1-[2-(phenylmethyl)butyl]indole-5-carboxylate

Systemtic Name: methyl 3-(methylaminomethyl)-1-[2-(phenylmethyl)butyl]indole-5-carboxylate Openeye Name: methyl 1-(2-benzylbutyl)-3-(methylaminomethyl)indole-5-carboxylate CAS Name: 3-(methylaminomethyl)-1-[2-(phenylmethyl)butyl]-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-(2-benzylbutyl)-3-(methylaminomethyl)indole-5-carboxylate Traditional Name: 1-(2-benzylbutyl)-3-(methylaminomethyl)indole-5-carboxylic acid methyl ester Formula: C23H28N2O2 MolecularWeight: 364.48062

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC=CC=C1)CN2C=C(C3=C2C=CC(=C3)C(=O)OC)CNC

Isomeric SMILES

CCC(CC1=CC=CC=C1)CN2C=C(C3=C2C=CC(=C3)C(=O)OC)CNC

InChI

InChI=1S/C23H28N2O2/c1-4-17(12-18-8-6-5-7-9-18)15-25-16-20(14-24-2)21-13-19(23(26)27-3)10-11-22(21)25/h5-11,13,16-17,24H,4,12,14-15H2,1-3H3