3-methoxy-4-[4-[4-[4-(2-methylpropyl)phenyl]carbonylpiperidin-1-yl]-4-oxidanylidene-butoxy]benzenecarbonitrile

Systemtic Name: 3-methoxy-4-[4-[4-[4-(2-methylpropyl)phenyl]carbonylpiperidin-1-yl]-4-oxidanylidene-butoxy]benzenecarbonitrile Openeye Name: 4-[4-[4-(4-isobutylbenzoyl)-1-piperidyl]-4-oxo-butoxy]-3-methoxy-benzonitrile CAS Name: 3-methoxy-4-[4-[4-[[4-(2-methylpropyl)phenyl]-oxomethyl]-1-piperidinyl]-4-oxobutoxy]benzonitrile IUPAC Name: 3-methoxy-4-[4-[4-[4-(2-methylpropyl)benzoyl]piperidin-1-yl]-4-oxobutoxy]benzonitrile Traditional Name: 4-[4-[4-(4-isobutylbenzoyl)piperidino]-4-keto-butoxy]-3-methoxy-benzonitrile Formula: C28H34N2O4 MolecularWeight: 462.58056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(=O)C2CCN(CC2)C(=O)CCCOC3=C(C=C(C=C3)C#N)OC

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C(=O)C2CCN(CC2)C(=O)CCCOC3=C(C=C(C=C3)C#N)OC

InChI

InChI=1S/C28H34N2O4/c1-20(2)17-21-6-9-23(10-7-21)28(32)24-12-14-30(15-13-24)27(31)5-4-16-34-25-11-8-22(19-29)18-26(25)33-3/h6-11,18,20,24H,4-5,12-17H2,1-3H3