methyl 3-[3-[di(propan-2-yl)amino]-1-phenyl-propyl]-4-oxidanyl-benzoate hydrochloride

Systemtic Name: methyl 3-[3-[di(propan-2-yl)amino]-1-phenyl-propyl]-4-oxidanyl-benzoate hydrochloride Openeye Name: methyl 3-[3-(diisopropylamino)-1-phenyl-propyl]-4-hydroxy-benzoate hydrochloride CAS Name: 3-[3-[di(propan-2-yl)amino]-1-phenylpropyl]-4-hydroxybenzoic acid methyl ester hydrochloride IUPAC Name: methyl 3-[3-[di(propan-2-yl)amino]-1-phenylpropyl]-4-hydroxybenzoate hydrochloride Traditional Name: 3-[3-(diisopropylamino)-1-phenyl-propyl]-4-hydroxy-benzoic acid methyl ester hydrochloride Formula: C23H32ClNO3 MolecularWeight: 405.95808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCC(C1=CC=CC=C1)C2=C(C=CC(=C2)C(=O)OC)O)C(C)C.Cl

Isomeric SMILES

CC(C)N(CCC(C1=CC=CC=C1)C2=C(C=CC(=C2)C(=O)OC)O)C(C)C.Cl

InChI

InChI=1S/C23H31NO3.ClH/c1-16(2)24(17(3)4)14-13-20(18-9-7-6-8-10-18)21-15-19(23(26)27-5)11-12-22(21)25;/h6-12,15-17,20,25H,13-14H2,1-5H3;1H