methyl 1-(4-methyl-2-phenyl-pentyl)-3-[(2-methylpropylamino)methyl]indole-5-carboxylate

Systemtic Name: methyl 1-(4-methyl-2-phenyl-pentyl)-3-[(2-methylpropylamino)methyl]indole-5-carboxylate Openeye Name: methyl 3-[(isobutylamino)methyl]-1-(4-methyl-2-phenyl-pentyl)indole-5-carboxylate CAS Name: 1-(4-methyl-2-phenylpentyl)-3-[(2-methylpropylamino)methyl]-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-methyl-2-phenylpentyl)-3-[(2-methylpropylamino)methyl]indole-5-carboxylate Traditional Name: 3-[(isobutylamino)methyl]-1-(4-methyl-2-phenyl-pentyl)indole-5-carboxylic acid methyl ester Formula: C27H36N2O2 MolecularWeight: 420.58694

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CN1C=C(C2=C1C=CC(=C2)C(=O)OC)CNCC(C)C)C3=CC=CC=C3

Isomeric SMILES

CC(C)CC(CN1C=C(C2=C1C=CC(=C2)C(=O)OC)CNCC(C)C)C3=CC=CC=C3

InChI

InChI=1S/C27H36N2O2/c1-19(2)13-23(21-9-7-6-8-10-21)17-29-18-24(16-28-15-20(3)4)25-14-22(27(30)31-5)11-12-26(25)29/h6-12,14,18-20,23,28H,13,15-17H2,1-5H3