3-methoxy-4-[4-oxidanylidene-4-[4-(phenylmethyl)piperidin-1-yl]butoxy]benzenecarbonitrile

Systemtic Name: 3-methoxy-4-[4-oxidanylidene-4-[4-(phenylmethyl)piperidin-1-yl]butoxy]benzenecarbonitrile Openeye Name: 4-[4-(4-benzyl-1-piperidyl)-4-oxo-butoxy]-3-methoxy-benzonitrile CAS Name: 3-methoxy-4-[4-oxo-4-[4-(phenylmethyl)-1-piperidinyl]butoxy]benzonitrile IUPAC Name: 4-[4-(4-benzylpiperidin-1-yl)-4-oxobutoxy]-3-methoxybenzonitrile Traditional Name: 4-[4-(4-benzylpiperidino)-4-keto-butoxy]-3-methoxy-benzonitrile Formula: C24H28N2O3 MolecularWeight: 392.49072

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C#N)OCCCC(=O)N2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)C#N)OCCCC(=O)N2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C24H28N2O3/c1-28-23-17-21(18-25)9-10-22(23)29-15-5-8-24(27)26-13-11-20(12-14-26)16-19-6-3-2-4-7-19/h2-4,6-7,9-10,17,20H,5,8,11-16H2,1H3