5-[4-[4-(1-cyclobutylpiperidin-4-yl)oxyphenyl]-3-oxidanylidene-piperazin-1-yl]carbonyl-2-methoxy-benzenecarbonitrile

Systemtic Name: 5-[4-[4-(1-cyclobutylpiperidin-4-yl)oxyphenyl]-3-oxidanylidene-piperazin-1-yl]carbonyl-2-methoxy-benzenecarbonitrile Openeye Name: 5-[4-[4-[(1-cyclobutyl-4-piperidyl)oxy]phenyl]-3-oxo-piperazine-1-carbonyl]-2-methoxy-benzonitrile CAS Name: 5-[[4-[4-[(1-cyclobutyl-4-piperidinyl)oxy]phenyl]-3-oxo-1-piperazinyl]-oxomethyl]-2-methoxybenzonitrile IUPAC Name: 5-[4-[4-(1-cyclobutylpiperidin-4-yl)oxyphenyl]-3-oxopiperazine-1-carbonyl]-2-methoxybenzonitrile Traditional Name: 5-[4-[4-[(1-cyclobutyl-4-piperidyl)oxy]phenyl]-3-keto-piperazine-1-carbonyl]-2-methoxy-benzonitrile Formula: C28H32N4O4 MolecularWeight: 488.57808

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCN(C(=O)C2)C3=CC=C(C=C3)OC4CCN(CC4)C5CCC5)C#N

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCN(C(=O)C2)C3=CC=C(C=C3)OC4CCN(CC4)C5CCC5)C#N

InChI

InChI=1S/C28H32N4O4/c1-35-26-10-5-20(17-21(26)18-29)28(34)31-15-16-32(27(33)19-31)23-6-8-24(9-7-23)36-25-11-13-30(14-12-25)22-3-2-4-22/h5-10,17,22,25H,2-4,11-16,19H2,1H3