6-[3-(dimethylamino)propyl]-6-phenethyl-cyclohexa-2,4-diene-1-carboxylate hydrochloride

Systemtic Name: 6-[3-(dimethylamino)propyl]-6-phenethyl-cyclohexa-2,4-diene-1-carboxylate hydrochloride Openeye Name: 6-[3-(dimethylamino)propyl]-6-phenethyl-cyclohexa-2,4-diene-1-carboxylate hydrochloride CAS Name: 6-[3-(dimethylamino)propyl]-6-phenethyl-1-cyclohexa-2,4-dienecarboxylate hydrochloride IUPAC Name: 6-[3-(dimethylamino)propyl]-6-phenethylcyclohexa-2,4-diene-1-carboxylate hydrochloride Traditional Name: 6-[3-(dimethylamino)propyl]-6-phenethyl-cyclohexa-2,4-diene-1-carboxylate hydrochloride Formula: C20H27ClNO2- MolecularWeight: 348.88688

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCC1(C=CC=CC1C(=O)[O-])CCC2=CC=CC=C2.Cl

Isomeric SMILES

CN(C)CCCC1(C=CC=CC1C(=O)[O-])CCC2=CC=CC=C2.Cl

InChI

InChI=1S/C20H27NO2.ClH/c1-21(2)16-8-14-20(13-7-6-11-18(20)19(22)23)15-12-17-9-4-3-5-10-17;/h3-7,9-11,13,18H,8,12,14-16H2,1-2H3,(H,22,23);1H/p-1