4-[4-[(3R,5S)-4-cyclobutyl-3,5-dimethyl-piperazin-1-yl]carbonylpiperidin-1-yl]benzenecarbonitrile

Systemtic Name: 4-[4-[(3R,5S)-4-cyclobutyl-3,5-dimethyl-piperazin-1-yl]carbonylpiperidin-1-yl]benzenecarbonitrile Openeye Name: 4-[4-[(3R,5S)-4-cyclobutyl-3,5-dimethyl-piperazine-1-carbonyl]-1-piperidyl]benzonitrile CAS Name: 4-[4-[[(3R,5S)-4-cyclobutyl-3,5-dimethyl-1-piperazinyl]-oxomethyl]-1-piperidinyl]benzonitrile IUPAC Name: 4-[4-[(3R,5S)-4-cyclobutyl-3,5-dimethylpiperazine-1-carbonyl]piperidin-1-yl]benzonitrile Traditional Name: 4-[4-[(3R,5S)-4-cyclobutyl-3,5-dimethyl-piperazine-1-carbonyl]piperidino]benzonitrile Formula: C23H32N4O MolecularWeight: 380.52638

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1C2CCC2)C)C(=O)C3CCN(CC3)C4=CC=C(C=C4)C#N

Isomeric SMILES

C[C@@H]1CN(C[C@@H](N1C2CCC2)C)C(=O)C3CCN(CC3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C23H32N4O/c1-17-15-26(16-18(2)27(17)22-4-3-5-22)23(28)20-10-12-25(13-11-20)21-8-6-19(14-24)7-9-21/h6-9,17-18,20,22H,3-5,10-13,15-16H2,1-2H3/t17-,18+