4-[4-[4-(1-cyclopentylpiperidin-4-yl)oxyphenyl]-3-oxidanylidene-piperazin-1-yl]carbonylbenzenecarbonitrile

Systemtic Name: 4-[4-[4-(1-cyclopentylpiperidin-4-yl)oxyphenyl]-3-oxidanylidene-piperazin-1-yl]carbonylbenzenecarbonitrile Openeye Name: 4-[4-[4-[(1-cyclopentyl-4-piperidyl)oxy]phenyl]-3-oxo-piperazine-1-carbonyl]benzonitrile CAS Name: 4-[[4-[4-[(1-cyclopentyl-4-piperidinyl)oxy]phenyl]-3-oxo-1-piperazinyl]-oxomethyl]benzonitrile IUPAC Name: 4-[4-[4-(1-cyclopentylpiperidin-4-yl)oxyphenyl]-3-oxopiperazine-1-carbonyl]benzonitrile Traditional Name: 4-[4-[4-[(1-cyclopentyl-4-piperidyl)oxy]phenyl]-3-keto-piperazine-1-carbonyl]benzonitrile Formula: C28H32N4O3 MolecularWeight: 472.57868

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2CCC(CC2)OC3=CC=C(C=C3)N4CCN(CC4=O)C(=O)C5=CC=C(C=C5)C#N

Isomeric SMILES

C1CCC(C1)N2CCC(CC2)OC3=CC=C(C=C3)N4CCN(CC4=O)C(=O)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C28H32N4O3/c29-19-21-5-7-22(8-6-21)28(34)31-17-18-32(27(33)20-31)24-9-11-25(12-10-24)35-26-13-15-30(16-14-26)23-3-1-2-4-23/h5-12,23,26H,1-4,13-18,20H2