5-bromanyl-2-[2-[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-2-oxidanylidene-ethoxy]benzaldehyde

Systemtic Name: 5-bromanyl-2-[2-[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-2-oxidanylidene-ethoxy]benzaldehyde Openeye Name: 5-bromo-2-[2-[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-2-oxo-ethoxy]benzaldehyde CAS Name: 5-bromo-2-[2-[(2R)-2-(2,5-dimethoxyphenyl)-1-pyrrolidinyl]-2-oxoethoxy]benzaldehyde IUPAC Name: 5-bromo-2-[2-[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-2-oxoethoxy]benzaldehyde Traditional Name: 5-bromo-2-[2-[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidino]-2-keto-ethoxy]benzaldehyde Formula: C21H22BrNO5 MolecularWeight: 448.30708

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2CCCN2C(=O)COC3=C(C=C(C=C3)Br)C=O

Isomeric SMILES

COC1=CC(=C(C=C1)OC)[C@H]2CCCN2C(=O)COC3=C(C=C(C=C3)Br)C=O

InChI

InChI=1S/C21H22BrNO5/c1-26-16-6-8-20(27-2)17(11-16)18-4-3-9-23(18)21(25)13-28-19-7-5-15(22)10-14(19)12-24/h5-8,10-12,18H,3-4,9,13H2,1-2H3/t18-/m1/s1