3-(3-bromophenyl)-6-butyl-10-methyl-2,4-dihydropyrano[3,2-g][1,3]benzoxazin-8-one

Systemtic Name: 3-(3-bromophenyl)-6-butyl-10-methyl-2,4-dihydropyrano[3,2-g][1,3]benzoxazin-8-one Openeye Name: 3-(3-bromophenyl)-6-butyl-10-methyl-2,4-dihydropyrano[3,2-g][1,3]benzoxazin-8-one CAS Name: 3-(3-bromophenyl)-6-butyl-10-methyl-2,4-dihydropyrano[3,2-g][1,3]benzoxazin-8-one IUPAC Name: 3-(3-bromophenyl)-6-butyl-10-methyl-2,4-dihydropyrano[3,2-g][1,3]benzoxazin-8-one Traditional Name: 3-(3-bromophenyl)-6-butyl-10-methyl-2,4-dihydropyrano[3,2-g][1,3]benzoxazin-8-one Formula: C22H22BrNO3 MolecularWeight: 428.31898

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C(C3=C(CN(CO3)C4=CC(=CC=C4)Br)C=C12)C

Isomeric SMILES

CCCCC1=CC(=O)OC2=C(C3=C(CN(CO3)C4=CC(=CC=C4)Br)C=C12)C

InChI

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