methyl 1-[4-methyl-2-(phenylmethyl)pentyl]-3-(propylaminomethyl)indole-5-carboxylate

Systemtic Name: methyl 1-[4-methyl-2-(phenylmethyl)pentyl]-3-(propylaminomethyl)indole-5-carboxylate Openeye Name: methyl 1-(2-benzyl-4-methyl-pentyl)-3-(propylaminomethyl)indole-5-carboxylate CAS Name: 1-[4-methyl-2-(phenylmethyl)pentyl]-3-(propylaminomethyl)-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-(2-benzyl-4-methylpentyl)-3-(propylaminomethyl)indole-5-carboxylate Traditional Name: 1-(2-benzyl-4-methyl-pentyl)-3-(propylaminomethyl)indole-5-carboxylic acid methyl ester Formula: C27H36N2O2 MolecularWeight: 420.58694

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Descriptors Computed from Structure

Canonical SMILES:

CCCNCC1=CN(C2=C1C=C(C=C2)C(=O)OC)CC(CC3=CC=CC=C3)CC(C)C

Isomeric SMILES

CCCNCC1=CN(C2=C1C=C(C=C2)C(=O)OC)CC(CC3=CC=CC=C3)CC(C)C

InChI

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