3-[1-[4-(methoxymethyl)cyclohexyl]piperidin-4-yl]-2-oxidanylidene-1,3-benzoxazole-5-carbonitrile hydrochloride

Systemtic Name: 3-[1-[4-(methoxymethyl)cyclohexyl]piperidin-4-yl]-2-oxidanylidene-1,3-benzoxazole-5-carbonitrile hydrochloride Openeye Name: 3-[1-[4-(methoxymethyl)cyclohexyl]-4-piperidyl]-2-oxo-1,3-benzoxazole-5-carbonitrile hydrochloride CAS Name: 3-[1-[4-(methoxymethyl)cyclohexyl]-4-piperidinyl]-2-oxo-1,3-benzoxazole-5-carbonitrile hydrochloride IUPAC Name: 3-[1-[4-(methoxymethyl)cyclohexyl]piperidin-4-yl]-2-oxo-1,3-benzoxazole-5-carbonitrile hydrochloride Traditional Name: 2-keto-3-[1-[4-(methoxymethyl)cyclohexyl]-4-piperidyl]-1,3-benzoxazole-5-carbonitrile hydrochloride Formula: C21H28ClN3O3 MolecularWeight: 405.91832

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Descriptors Computed from Structure

Canonical SMILES:

COCC1CCC(CC1)N2CCC(CC2)N3C4=C(C=CC(=C4)C#N)OC3=O.Cl

Isomeric SMILES

COCC1CCC(CC1)N2CCC(CC2)N3C4=C(C=CC(=C4)C#N)OC3=O.Cl

InChI

InChI=1S/C21H27N3O3.ClH/c1-26-14-15-2-5-17(6-3-15)23-10-8-18(9-11-23)24-19-12-16(13-22)4-7-20(19)27-21(24)25;/h4,7,12,15,17-18H,2-3,5-6,8-11,14H2,1H3;1H