7-bromanyl-4-[2-[2-(3-methoxyphenyl)pyrrolidin-1-yl]-2-oxidanylidene-ethyl]-1,4-benzoxazin-3-one

Systemtic Name: 7-bromanyl-4-[2-[2-(3-methoxyphenyl)pyrrolidin-1-yl]-2-oxidanylidene-ethyl]-1,4-benzoxazin-3-one Openeye Name: 7-bromo-4-[2-[2-(3-methoxyphenyl)pyrrolidin-1-yl]-2-oxo-ethyl]-1,4-benzoxazin-3-one CAS Name: 7-bromo-4-[2-[2-(3-methoxyphenyl)-1-pyrrolidinyl]-2-oxoethyl]-1,4-benzoxazin-3-one IUPAC Name: 7-bromo-4-[2-[2-(3-methoxyphenyl)pyrrolidin-1-yl]-2-oxoethyl]-1,4-benzoxazin-3-one Traditional Name: 7-bromo-4-[2-keto-2-[2-(3-methoxyphenyl)pyrrolidino]ethyl]-1,4-benzoxazin-3-one Formula: C21H21BrN2O4 MolecularWeight: 445.30644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2CCCN2C(=O)CN3C(=O)COC4=C3C=CC(=C4)Br

Isomeric SMILES

COC1=CC=CC(=C1)C2CCCN2C(=O)CN3C(=O)COC4=C3C=CC(=C4)Br

InChI

InChI=1S/C21H21BrN2O4/c1-27-16-5-2-4-14(10-16)17-6-3-9-23(17)20(25)12-24-18-8-7-15(22)11-19(18)28-13-21(24)26/h2,4-5,7-8,10-11,17H,3,6,9,12-13H2,1H3