4-[[5-(3-chlorophenyl)furan-2-yl]methyl-piperidin-4-yl-amino]-6-methyl-chromen-2-one

Systemtic Name: 4-[[5-(3-chlorophenyl)furan-2-yl]methyl-piperidin-4-yl-amino]-6-methyl-chromen-2-one Openeye Name: 4-[[5-(3-chlorophenyl)-2-furyl]methyl-(4-piperidyl)amino]-6-methyl-chromen-2-one CAS Name: 4-[[5-(3-chlorophenyl)-2-furanyl]methyl-(4-piperidinyl)amino]-6-methyl-1-benzopyran-2-one IUPAC Name: 4-[[5-(3-chlorophenyl)furan-2-yl]methyl-piperidin-4-ylamino]-6-methylchromen-2-one Traditional Name: 4-[[5-(3-chlorophenyl)-2-furyl]methyl-(4-piperidyl)amino]-6-methyl-coumarin Formula: C26H25ClN2O3 MolecularWeight: 448.9413

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=O)C=C2N(CC3=CC=C(O3)C4=CC(=CC=C4)Cl)C5CCNCC5

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=O)C=C2N(CC3=CC=C(O3)C4=CC(=CC=C4)Cl)C5CCNCC5

InChI

InChI=1S/C26H25ClN2O3/c1-17-5-7-25-22(13-17)23(15-26(30)32-25)29(20-9-11-28-12-10-20)16-21-6-8-24(31-21)18-3-2-4-19(27)14-18/h2-8,13-15,20,28H,9-12,16H2,1H3