7-bromanyl-4-[[2-(4-ethoxyphenyl)pyrrolidin-1-yl]methyl]chromen-2-one

Systemtic Name: 7-bromanyl-4-[[2-(4-ethoxyphenyl)pyrrolidin-1-yl]methyl]chromen-2-one Openeye Name: 7-bromo-4-[[2-(4-ethoxyphenyl)pyrrolidin-1-yl]methyl]chromen-2-one CAS Name: 7-bromo-4-[[2-(4-ethoxyphenyl)-1-pyrrolidinyl]methyl]-1-benzopyran-2-one IUPAC Name: 7-bromo-4-[[2-(4-ethoxyphenyl)pyrrolidin-1-yl]methyl]chromen-2-one Traditional Name: 7-bromo-4-[(2-p-phenetylpyrrolidino)methyl]coumarin Formula: C22H22BrNO3 MolecularWeight: 428.31898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2CCCN2CC3=CC(=O)OC4=C3C=CC(=C4)Br

Isomeric SMILES

CCOC1=CC=C(C=C1)C2CCCN2CC3=CC(=O)OC4=C3C=CC(=C4)Br

InChI

InChI=1S/C22H22BrNO3/c1-2-26-18-8-5-15(6-9-18)20-4-3-11-24(20)14-16-12-22(25)27-21-13-17(23)7-10-19(16)21/h5-10,12-13,20H,2-4,11,14H2,1H3