ethyl 2-[3-(dimethylamino)-2-oxidanyl-propoxy]-6-methyl-3-propan-2-yl-benzoate

Systemtic Name: ethyl 2-[3-(dimethylamino)-2-oxidanyl-propoxy]-6-methyl-3-propan-2-yl-benzoate Openeye Name: ethyl 2-[3-(dimethylamino)-2-hydroxy-propoxy]-3-isopropyl-6-methyl-benzoate CAS Name: 2-[3-(dimethylamino)-2-hydroxypropoxy]-6-methyl-3-propan-2-ylbenzoic acid ethyl ester IUPAC Name: ethyl 2-[3-(dimethylamino)-2-hydroxypropoxy]-6-methyl-3-propan-2-ylbenzoate Traditional Name: 2-[3-(dimethylamino)-2-hydroxy-propoxy]-3-isopropyl-6-methyl-benzoic acid ethyl ester Formula: C18H29NO4 MolecularWeight: 323.42716

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1OCC(CN(C)C)O)C(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1OCC(CN(C)C)O)C(C)C)C

InChI

InChI=1S/C18H29NO4/c1-7-22-18(21)16-13(4)8-9-15(12(2)3)17(16)23-11-14(20)10-19(5)6/h8-9,12,14,20H,7,10-11H2,1-6H3