3-(2-chlorophenyl)-2-methyl-7-oxidanyl-8-[(4-piperidin-1-ylcarbonylpiperazin-1-yl)methyl]chromen-4-one

Systemtic Name: 3-(2-chlorophenyl)-2-methyl-7-oxidanyl-8-[(4-piperidin-1-ylcarbonylpiperazin-1-yl)methyl]chromen-4-one Openeye Name: 3-(2-chlorophenyl)-7-hydroxy-2-methyl-8-[[4-(piperidine-1-carbonyl)piperazin-1-yl]methyl]chromen-4-one CAS Name: 3-(2-chlorophenyl)-7-hydroxy-2-methyl-8-[[4-[oxo(1-piperidinyl)methyl]-1-piperazinyl]methyl]-1-benzopyran-4-one IUPAC Name: 3-(2-chlorophenyl)-7-hydroxy-2-methyl-8-[[4-(piperidine-1-carbonyl)piperazin-1-yl]methyl]chromen-4-one Traditional Name: 3-(2-chlorophenyl)-7-hydroxy-2-methyl-8-[[4-(piperidine-1-carbonyl)piperazino]methyl]chromone Formula: C27H30ClN3O4 MolecularWeight: 495.9978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C(=C(C=C2)O)CN3CCN(CC3)C(=O)N4CCCCC4)C5=CC=CC=C5Cl

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C(=C(C=C2)O)CN3CCN(CC3)C(=O)N4CCCCC4)C5=CC=CC=C5Cl

InChI

InChI=1S/C27H30ClN3O4/c1-18-24(19-7-3-4-8-22(19)28)25(33)20-9-10-23(32)21(26(20)35-18)17-29-13-15-31(16-14-29)27(34)30-11-5-2-6-12-30/h3-4,7-10,32H,2,5-6,11-17H2,1H3