4-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]carbonylbenzenecarbonitrile

Systemtic Name: 4-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]carbonylbenzenecarbonitrile Openeye Name: 4-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]benzonitrile CAS Name: 4-[[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-oxomethyl]benzonitrile IUPAC Name: 4-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]benzonitrile Traditional Name: 4-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]benzonitrile Formula: C20H25N3O2 MolecularWeight: 339.4314

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H25N3O2/c21-15-16-5-7-17(8-6-16)19(24)23-13-9-18(10-14-23)20(25)22-11-3-1-2-4-12-22/h5-8,18H,1-4,9-14H2