[3-(propylamino)-2,3-dihydro-1H-inden-5-yl] (Z)-octadec-9-enoate hydrochloride

Systemtic Name: [3-(propylamino)-2,3-dihydro-1H-inden-5-yl] (Z)-octadec-9-enoate hydrochloride Openeye Name: [3-(propylamino)indan-5-yl] (Z)-octadec-9-enoate hydrochloride CAS Name: (Z)-9-octadecenoic acid [3-(propylamino)-2,3-dihydro-1H-inden-5-yl] ester hydrochloride IUPAC Name: [3-(propylamino)-2,3-dihydro-1H-inden-5-yl] (Z)-octadec-9-enoate hydrochloride Traditional Name: (Z)-octadec-9-enoic acid [3-(propylamino)indan-5-yl] ester hydrochloride Formula: C30H50ClNO2 MolecularWeight: 492.1765

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OC1=CC2=C(CCC2NCCC)C=C1.Cl

Isomeric SMILES

CCCCCCCC/C=C\CCCCCCCC(=O)OC1=CC2=C(CCC2NCCC)C=C1.Cl

InChI

InChI=1S/C30H49NO2.ClH/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-30(32)33-27-22-20-26-21-23-29(28(26)25-27)31-24-4-2;/h11-12,20,22,25,29,31H,3-10,13-19,21,23-24H2,1-2H3;1H/b12-11-;