3-(2,4-dichlorophenyl)-8-methyl-7-oxidanyl-4-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]chromen-2-one

Systemtic Name: 3-(2,4-dichlorophenyl)-8-methyl-7-oxidanyl-4-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]chromen-2-one Openeye Name: 3-(2,4-dichlorophenyl)-7-hydroxy-8-methyl-4-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]chromen-2-one CAS Name: 3-(2,4-dichlorophenyl)-7-hydroxy-8-methyl-4-[[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]methyl]-1-benzopyran-2-one IUPAC Name: 3-(2,4-dichlorophenyl)-7-hydroxy-8-methyl-4-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]chromen-2-one Traditional Name: 3-(2,4-dichlorophenyl)-7-hydroxy-8-methyl-4-[4-(2-pyrrolidinoethoxy)benzyl]coumarin Formula: C29H27Cl2NO4 MolecularWeight: 524.43498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C(=C2CC3=CC=C(C=C3)OCCN4CCCC4)C5=C(C=C(C=C5)Cl)Cl)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C(=C2CC3=CC=C(C=C3)OCCN4CCCC4)C5=C(C=C(C=C5)Cl)Cl)O

InChI

InChI=1S/C29H27Cl2NO4/c1-18-26(33)11-10-22-24(27(29(34)36-28(18)22)23-9-6-20(30)17-25(23)31)16-19-4-7-21(8-5-19)35-15-14-32-12-2-3-13-32/h4-11,17,33H,2-3,12-16H2,1H3