4-[3-(tert-butylamino)-2-oxidanyl-propoxy]-3-methoxy-benzenecarbonitrile hydrochloride

Systemtic Name: 4-[3-(tert-butylamino)-2-oxidanyl-propoxy]-3-methoxy-benzenecarbonitrile hydrochloride Openeye Name: 4-[3-(tert-butylamino)-2-hydroxy-propoxy]-3-methoxy-benzonitrile hydrochloride CAS Name: 4-[3-(tert-butylamino)-2-hydroxypropoxy]-3-methoxybenzonitrile hydrochloride IUPAC Name: 4-[3-(tert-butylamino)-2-hydroxypropoxy]-3-methoxybenzonitrile hydrochloride Traditional Name: 4-[3-(tert-butylamino)-2-hydroxy-propoxy]-3-methoxy-benzonitrile hydrochloride Formula: C15H23ClN2O3 MolecularWeight: 314.80772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(COC1=C(C=C(C=C1)C#N)OC)O.Cl

Isomeric SMILES

CC(C)(C)NCC(COC1=C(C=C(C=C1)C#N)OC)O.Cl

InChI

InChI=1S/C15H22N2O3.ClH/c1-15(2,3)17-9-12(18)10-20-13-6-5-11(8-16)7-14(13)19-4;/h5-7,12,17-18H,9-10H2,1-4H3;1H