methyl 1-(4-methyl-2-propyl-pentyl)-3-(phenylazanylmethyl)indole-5-carboxylate

Systemtic Name: methyl 1-(4-methyl-2-propyl-pentyl)-3-(phenylazanylmethyl)indole-5-carboxylate Openeye Name: methyl 3-(anilinomethyl)-1-(4-methyl-2-propyl-pentyl)indole-5-carboxylate CAS Name: 3-(anilinomethyl)-1-(4-methyl-2-propylpentyl)-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 3-(anilinomethyl)-1-(4-methyl-2-propylpentyl)indole-5-carboxylate Traditional Name: 3-(anilinomethyl)-1-(4-methyl-2-propyl-pentyl)indole-5-carboxylic acid methyl ester Formula: C26H34N2O2 MolecularWeight: 406.56036

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC(C)C)CN1C=C(C2=C1C=CC(=C2)C(=O)OC)CNC3=CC=CC=C3

Isomeric SMILES

CCCC(CC(C)C)CN1C=C(C2=C1C=CC(=C2)C(=O)OC)CNC3=CC=CC=C3

InChI

InChI=1S/C26H34N2O2/c1-5-9-20(14-19(2)3)17-28-18-22(16-27-23-10-7-6-8-11-23)24-15-21(26(29)30-4)12-13-25(24)28/h6-8,10-13,15,18-20,27H,5,9,14,16-17H2,1-4H3