2-(4-bromophenyl)-3-[(4-nitrophenyl)amino]-2,3-dihydrochromen-4-one

Systemtic Name: 2-(4-bromophenyl)-3-[(4-nitrophenyl)amino]-2,3-dihydrochromen-4-one Openeye Name: 2-(4-bromophenyl)-3-(4-nitroanilino)chroman-4-one CAS Name: 2-(4-bromophenyl)-3-(4-nitroanilino)-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: 2-(4-bromophenyl)-3-(4-nitroanilino)-2,3-dihydrochromen-4-one Traditional Name: 2-(4-bromophenyl)-3-(4-nitroanilino)chroman-4-one Formula: C21H15BrN2O4 MolecularWeight: 439.2588

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(C(O2)C3=CC=C(C=C3)Br)NC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C(C(O2)C3=CC=C(C=C3)Br)NC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H15BrN2O4/c22-14-7-5-13(6-8-14)21-19(20(25)17-3-1-2-4-18(17)28-21)23-15-9-11-16(12-10-15)24(26)27/h1-12,19,21,23H