(phenylmethyl) 5-[[3-(2-azanylethyl)-1H-indol-5-yl]oxy]pentanoate hydrochloride

Systemtic Name: (phenylmethyl) 5-[[3-(2-azanylethyl)-1H-indol-5-yl]oxy]pentanoate hydrochloride Openeye Name: benzyl 5-[[3-(2-aminoethyl)-1H-indol-5-yl]oxy]pentanoate hydrochloride CAS Name: 5-[[3-(2-aminoethyl)-1H-indol-5-yl]oxy]pentanoic acid (phenylmethyl) ester hydrochloride IUPAC Name: benzyl 5-[[3-(2-aminoethyl)-1H-indol-5-yl]oxy]pentanoate hydrochloride Traditional Name: 5-[[3-(2-aminoethyl)-1H-indol-5-yl]oxy]valeric acid benzyl ester hydrochloride Formula: C22H27ClN2O3 MolecularWeight: 402.91438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCCCOC2=CC3=C(C=C2)NC=C3CCN.Cl

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CCCCOC2=CC3=C(C=C2)NC=C3CCN.Cl

InChI

InChI=1S/C22H26N2O3.ClH/c23-12-11-18-15-24-21-10-9-19(14-20(18)21)26-13-5-4-8-22(25)27-16-17-6-2-1-3-7-17;/h1-3,6-7,9-10,14-15,24H,4-5,8,11-13,16,23H2;1H