3-[3-[(5-bromanyl-3-chloranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]chromen-2-one

Systemtic Name: 3-[3-[(5-bromanyl-3-chloranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]chromen-2-one Openeye Name: 3-[3-[(5-bromo-3-chloro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]chromen-2-one CAS Name: 3-[3-[(5-bromo-3-chloro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]phenyl]-1-benzopyran-2-one IUPAC Name: 3-[3-[(5-bromo-3-chloro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]chromen-2-one Traditional Name: 3-[3-[(5-bromo-3-chloro-6-keto-cyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]coumarin Formula: C22H13BrClNO3 MolecularWeight: 454.70052

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=O)O2)C3=CC(=CC=C3)NC=C4C=C(C=C(C4=O)Br)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=O)O2)C3=CC(=CC=C3)NC=C4C=C(C=C(C4=O)Br)Cl

InChI

InChI=1S/C22H13BrClNO3/c23-19-11-16(24)8-15(21(19)26)12-25-17-6-3-5-13(9-17)18-10-14-4-1-2-7-20(14)28-22(18)27/h1-12,25H