N-[2-cyano-4,4-dimethyl-1-oxidanylidene-1-(piperidin-4-ylamino)hexan-2-yl]-3-phenoxy-benzamide

Systemtic Name: N-[2-cyano-4,4-dimethyl-1-oxidanylidene-1-(piperidin-4-ylamino)hexan-2-yl]-3-phenoxy-benzamide Openeye Name: N-[1-cyano-3,3-dimethyl-1-(4-piperidylcarbamoyl)pentyl]-3-phenoxy-benzamide CAS Name: N-[2-cyano-4,4-dimethyl-1-oxo-1-(4-piperidinylamino)hexan-2-yl]-3-phenoxybenzamide IUPAC Name: N-[2-cyano-4,4-dimethyl-1-oxo-1-(piperidin-4-ylamino)hexan-2-yl]-3-phenoxybenzamide Traditional Name: N-[1-cyano-3,3-dimethyl-1-(4-piperidylcarbamoyl)pentyl]-3-phenoxy-benzamide Formula: C27H34N4O3 MolecularWeight: 462.58386

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)CC(C#N)(C(=O)NC1CCNCC1)NC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

CCC(C)(C)CC(C#N)(C(=O)NC1CCNCC1)NC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C27H34N4O3/c1-4-26(2,3)18-27(19-28,25(33)30-21-13-15-29-16-14-21)31-24(32)20-9-8-12-23(17-20)34-22-10-6-5-7-11-22/h5-12,17,21,29H,4,13-16,18H2,1-3H3,(H,30,33)(H,31,32)