3-[3-(4-chlorophenyl)carbonylpiperidin-1-yl]carbonylchromen-2-one

Systemtic Name: 3-[3-(4-chlorophenyl)carbonylpiperidin-1-yl]carbonylchromen-2-one Openeye Name: 3-[3-(4-chlorobenzoyl)piperidine-1-carbonyl]chromen-2-one CAS Name: 3-[[3-[(4-chlorophenyl)-oxomethyl]-1-piperidinyl]-oxomethyl]-1-benzopyran-2-one IUPAC Name: 3-[3-(4-chlorobenzoyl)piperidine-1-carbonyl]chromen-2-one Traditional Name: 3-[3-(4-chlorobenzoyl)piperidine-1-carbonyl]coumarin Formula: C22H18ClNO4 MolecularWeight: 395.83562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC3=CC=CC=C3OC2=O)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC3=CC=CC=C3OC2=O)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H18ClNO4/c23-17-9-7-14(8-10-17)20(25)16-5-3-11-24(13-16)21(26)18-12-15-4-1-2-6-19(15)28-22(18)27/h1-2,4,6-10,12,16H,3,5,11,13H2