2-[4-(6-chloranyl-2-oxidanylidene-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]-N-(4-cyanophenyl)ethanamide

Systemtic Name: 2-[4-(6-chloranyl-2-oxidanylidene-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]-N-(4-cyanophenyl)ethanamide Openeye Name: 2-[4-(6-chloro-2-oxo-4H-3,1-benzoxazin-1-yl)-1-piperidyl]-N-(4-cyanophenyl)acetamide CAS Name: 2-[4-(6-chloro-2-oxo-4H-3,1-benzoxazin-1-yl)-1-piperidinyl]-N-(4-cyanophenyl)acetamide IUPAC Name: 2-[4-(6-chloro-2-oxo-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]-N-(4-cyanophenyl)acetamide Traditional Name: 2-[4-(6-chloro-2-keto-4H-3,1-benzoxazin-1-yl)piperidino]-N-(4-cyanophenyl)acetamide Formula: C22H21ClN4O3 MolecularWeight: 424.88014

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=C(COC2=O)C=C(C=C3)Cl)CC(=O)NC4=CC=C(C=C4)C#N

Isomeric SMILES

C1CN(CCC1N2C3=C(COC2=O)C=C(C=C3)Cl)CC(=O)NC4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H21ClN4O3/c23-17-3-6-20-16(11-17)14-30-22(29)27(20)19-7-9-26(10-8-19)13-21(28)25-18-4-1-15(12-24)2-5-18/h1-6,11,19H,7-10,13-14H2,(H,25,28)