[4-(4-methylphenyl)carbonyloxy-5-(2-piperidin-1-ylethyl)naphthalen-2-yl] 4-methylbenzoate hydrochloride

Systemtic Name: [4-(4-methylphenyl)carbonyloxy-5-(2-piperidin-1-ylethyl)naphthalen-2-yl] 4-methylbenzoate hydrochloride Openeye Name: [4-(4-methylbenzoyl)oxy-5-[2-(1-piperidyl)ethyl]-2-naphthyl] 4-methylbenzoate hydrochloride CAS Name: 4-methylbenzoic acid [4-[(4-methylphenyl)-oxomethoxy]-5-[2-(1-piperidinyl)ethyl]-2-naphthalenyl] ester hydrochloride IUPAC Name: [4-(4-methylbenzoyl)oxy-5-(2-piperidin-1-ylethyl)naphthalen-2-yl] 4-methylbenzoate hydrochloride Traditional Name: 4-methylbenzoic acid [5-(2-piperidinoethyl)-4-p-toluoyloxy-2-naphthyl] ester hydrochloride Formula: C33H34ClNO4 MolecularWeight: 544.08036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=CC(=C3C(=C2)C=CC=C3CCN4CCCCC4)OC(=O)C5=CC=C(C=C5)C.Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=CC(=C3C(=C2)C=CC=C3CCN4CCCCC4)OC(=O)C5=CC=C(C=C5)C.Cl

InChI

InChI=1S/C33H33NO4.ClH/c1-23-9-13-26(14-10-23)32(35)37-29-21-28-8-6-7-25(17-20-34-18-4-3-5-19-34)31(28)30(22-29)38-33(36)27-15-11-24(2)12-16-27;/h6-16,21-22H,3-5,17-20H2,1-2H3;1H