3-pyrrolidin-1-ylbutan-2-yl 4-propan-2-yloxybenzoate hydrochloride

Systemtic Name: 3-pyrrolidin-1-ylbutan-2-yl 4-propan-2-yloxybenzoate hydrochloride Openeye Name: (1-methyl-2-pyrrolidin-1-yl-propyl) 4-isopropoxybenzoate hydrochloride CAS Name: 4-propan-2-yloxybenzoic acid 3-(1-pyrrolidinyl)butan-2-yl ester hydrochloride IUPAC Name: 3-pyrrolidin-1-ylbutan-2-yl 4-propan-2-yloxybenzoate hydrochloride Traditional Name: 4-isopropoxybenzoic acid (1-methyl-2-pyrrolidino-propyl) ester hydrochloride Formula: C18H28ClNO3 MolecularWeight: 341.87282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(=O)OC(C)C(C)N2CCCC2.Cl

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C(=O)OC(C)C(C)N2CCCC2.Cl

InChI

InChI=1S/C18H27NO3.ClH/c1-13(2)21-17-9-7-16(8-10-17)18(20)22-15(4)14(3)19-11-5-6-12-19;/h7-10,13-15H,5-6,11-12H2,1-4H3;1H