7-methoxy-2-(4-methylphenyl)-3-phenyl-8-(pyrrolidin-1-ylmethyl)chromen-4-one

Systemtic Name: 7-methoxy-2-(4-methylphenyl)-3-phenyl-8-(pyrrolidin-1-ylmethyl)chromen-4-one Openeye Name: 7-methoxy-3-phenyl-2-(p-tolyl)-8-(pyrrolidin-1-ylmethyl)chromen-4-one CAS Name: 7-methoxy-2-(4-methylphenyl)-3-phenyl-8-(1-pyrrolidinylmethyl)-1-benzopyran-4-one IUPAC Name: 7-methoxy-2-(4-methylphenyl)-3-phenyl-8-(pyrrolidin-1-ylmethyl)chromen-4-one Traditional Name: 7-methoxy-3-phenyl-2-(p-tolyl)-8-(pyrrolidinomethyl)chromone Formula: C28H27NO3 MolecularWeight: 425.51888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C(=C(C=C3)OC)CN4CCCC4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C(=C(C=C3)OC)CN4CCCC4)C5=CC=CC=C5

InChI

InChI=1S/C28H27NO3/c1-19-10-12-21(13-11-19)27-25(20-8-4-3-5-9-20)26(30)22-14-15-24(31-2)23(28(22)32-27)18-29-16-6-7-17-29/h3-5,8-15H,6-7,16-18H2,1-2H3