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

Systemtic Name: methyl 1-[2-(phenylmethyl)pentyl]-3-(propylaminomethyl)indole-5-carboxylate Openeye Name: methyl 1-(2-benzylpentyl)-3-(propylaminomethyl)indole-5-carboxylate CAS Name: 1-[2-(phenylmethyl)pentyl]-3-(propylaminomethyl)-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-(2-benzylpentyl)-3-(propylaminomethyl)indole-5-carboxylate Traditional Name: 1-(2-benzylpentyl)-3-(propylaminomethyl)indole-5-carboxylic acid methyl ester Formula: C26H34N2O2 MolecularWeight: 406.56036

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC1=CC=CC=C1)CN2C=C(C3=C2C=CC(=C3)C(=O)OC)CNCCC

Isomeric SMILES

CCCC(CC1=CC=CC=C1)CN2C=C(C3=C2C=CC(=C3)C(=O)OC)CNCCC

InChI

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