4-[[3-(4-methoxyphenoxy)phenyl]methyl-piperidin-4-yl-amino]-6-methyl-chromen-2-one

Systemtic Name: 4-[[3-(4-methoxyphenoxy)phenyl]methyl-piperidin-4-yl-amino]-6-methyl-chromen-2-one Openeye Name: 4-[[3-(4-methoxyphenoxy)phenyl]methyl-(4-piperidyl)amino]-6-methyl-chromen-2-one CAS Name: 4-[[3-(4-methoxyphenoxy)phenyl]methyl-(4-piperidinyl)amino]-6-methyl-1-benzopyran-2-one IUPAC Name: 4-[[3-(4-methoxyphenoxy)phenyl]methyl-piperidin-4-ylamino]-6-methylchromen-2-one Traditional Name: 4-[[3-(4-methoxyphenoxy)benzyl]-(4-piperidyl)amino]-6-methyl-coumarin Formula: C29H30N2O4 MolecularWeight: 470.5595

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=O)C=C2N(CC3=CC(=CC=C3)OC4=CC=C(C=C4)OC)C5CCNCC5

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=O)C=C2N(CC3=CC(=CC=C3)OC4=CC=C(C=C4)OC)C5CCNCC5

InChI

InChI=1S/C29H30N2O4/c1-20-6-11-28-26(16-20)27(18-29(32)35-28)31(22-12-14-30-15-13-22)19-21-4-3-5-25(17-21)34-24-9-7-23(33-2)8-10-24/h3-11,16-18,22,30H,12-15,19H2,1-2H3