3-butyl-7-methoxy-4-methyl-6-[3-(4-phenylpiperidin-1-yl)propoxy]chromen-2-one

Systemtic Name: 3-butyl-7-methoxy-4-methyl-6-[3-(4-phenylpiperidin-1-yl)propoxy]chromen-2-one Openeye Name: 3-butyl-7-methoxy-4-methyl-6-[3-(4-phenyl-1-piperidyl)propoxy]chromen-2-one CAS Name: 3-butyl-7-methoxy-4-methyl-6-[3-(4-phenyl-1-piperidinyl)propoxy]-1-benzopyran-2-one IUPAC Name: 3-butyl-7-methoxy-4-methyl-6-[3-(4-phenylpiperidin-1-yl)propoxy]chromen-2-one Traditional Name: 3-butyl-7-methoxy-4-methyl-6-[3-(4-phenylpiperidino)propoxy]coumarin Formula: C29H37NO4 MolecularWeight: 463.60838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC(=C(C=C2OC1=O)OC)OCCCN3CCC(CC3)C4=CC=CC=C4)C

Isomeric SMILES

CCCCC1=C(C2=CC(=C(C=C2OC1=O)OC)OCCCN3CCC(CC3)C4=CC=CC=C4)C

InChI

InChI=1S/C29H37NO4/c1-4-5-12-24-21(2)25-19-28(27(32-3)20-26(25)34-29(24)31)33-18-9-15-30-16-13-23(14-17-30)22-10-7-6-8-11-22/h6-8,10-11,19-20,23H,4-5,9,12-18H2,1-3H3