4-[2-[4-(1-adamantylcarbonyl)piperazin-1-yl]-2-oxidanylidene-ethoxy]benzenecarbonitrile

Systemtic Name: 4-[2-[4-(1-adamantylcarbonyl)piperazin-1-yl]-2-oxidanylidene-ethoxy]benzenecarbonitrile Openeye Name: 4-[2-[4-(adamantane-1-carbonyl)piperazin-1-yl]-2-oxo-ethoxy]benzonitrile CAS Name: 4-[2-[4-[1-adamantyl(oxo)methyl]-1-piperazinyl]-2-oxoethoxy]benzonitrile IUPAC Name: 4-[2-[4-(adamantane-1-carbonyl)piperazin-1-yl]-2-oxoethoxy]benzonitrile Traditional Name: 4-[2-[4-(adamantane-1-carbonyl)piperazino]-2-keto-ethoxy]benzonitrile Formula: C24H29N3O3 MolecularWeight: 407.50536

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)COC2=CC=C(C=C2)C#N)C(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CN(CCN1C(=O)COC2=CC=C(C=C2)C#N)C(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H29N3O3/c25-15-17-1-3-21(4-2-17)30-16-22(28)26-5-7-27(8-6-26)23(29)24-12-18-9-19(13-24)11-20(10-18)14-24/h1-4,18-20H,5-14,16H2