1-[3-(cyclopropylmethoxy)-4-methoxy-phenyl]-4-(hydroxymethyl)cyclohexane-1-carbonitrile

Systemtic Name: 1-[3-(cyclopropylmethoxy)-4-methoxy-phenyl]-4-(hydroxymethyl)cyclohexane-1-carbonitrile Openeye Name: 1-[3-(cyclopropylmethoxy)-4-methoxy-phenyl]-4-(hydroxymethyl)cyclohexanecarbonitrile CAS Name: 1-[3-(cyclopropylmethoxy)-4-methoxyphenyl]-4-(hydroxymethyl)-1-cyclohexanecarbonitrile IUPAC Name: 1-[3-(cyclopropylmethoxy)-4-methoxyphenyl]-4-(hydroxymethyl)cyclohexane-1-carbonitrile Traditional Name: 1-[3-(cyclopropylmethoxy)-4-methoxy-phenyl]-4-methylol-cyclohexanecarbonitrile Formula: C19H25NO3 MolecularWeight: 315.4067

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(CCC(CC2)CO)C#N)OCC3CC3

Isomeric SMILES

COC1=C(C=C(C=C1)C2(CCC(CC2)CO)C#N)OCC3CC3

InChI

InChI=1S/C19H25NO3/c1-22-17-5-4-16(10-18(17)23-12-15-2-3-15)19(13-20)8-6-14(11-21)7-9-19/h4-5,10,14-15,21H,2-3,6-9,11-12H2,1H3