phenyl N-[2-chloranyl-5-[4-(4-cyanophenyl)piperidin-1-yl]carbonyl-phenyl]carbamate

Systemtic Name: phenyl N-[2-chloranyl-5-[4-(4-cyanophenyl)piperidin-1-yl]carbonyl-phenyl]carbamate Openeye Name: phenyl N-[2-chloro-5-[4-(4-cyanophenyl)piperidine-1-carbonyl]phenyl]carbamate CAS Name: N-[2-chloro-5-[[4-(4-cyanophenyl)-1-piperidinyl]-oxomethyl]phenyl]carbamic acid phenyl ester IUPAC Name: phenyl N-[2-chloro-5-[4-(4-cyanophenyl)piperidine-1-carbonyl]phenyl]carbamate Traditional Name: N-[2-chloro-5-[4-(4-cyanophenyl)piperidine-1-carbonyl]phenyl]carbamic acid phenyl ester Formula: C26H22ClN3O3 MolecularWeight: 459.92418

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CC=C(C=C2)C#N)C(=O)C3=CC(=C(C=C3)Cl)NC(=O)OC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C2=CC=C(C=C2)C#N)C(=O)C3=CC(=C(C=C3)Cl)NC(=O)OC4=CC=CC=C4

InChI

InChI=1S/C26H22ClN3O3/c27-23-11-10-21(16-24(23)29-26(32)33-22-4-2-1-3-5-22)25(31)30-14-12-20(13-15-30)19-8-6-18(17-28)7-9-19/h1-11,16,20H,12-15H2,(H,29,32)