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

Systemtic Name: 3-[4-[(5-bromanyl-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-2-methyl-phenyl]chromen-2-one Openeye Name: 3-[4-[(5-bromo-3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-2-methyl-phenyl]chromen-2-one CAS Name: 3-[4-[(5-bromo-3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-2-methylphenyl]-1-benzopyran-2-one IUPAC Name: 3-[4-[(5-bromo-3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-2-methylphenyl]chromen-2-one Traditional Name: 3-[4-[(5-bromo-6-keto-3-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]-2-methyl-phenyl]coumarin Formula: C23H15BrN2O5 MolecularWeight: 479.2796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC=C2C=C(C=C(C2=O)Br)[N+](=O)[O-])C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

CC1=C(C=CC(=C1)NC=C2C=C(C=C(C2=O)Br)[N+](=O)[O-])C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C23H15BrN2O5/c1-13-8-16(25-12-15-9-17(26(29)30)11-20(24)22(15)27)6-7-18(13)19-10-14-4-2-3-5-21(14)31-23(19)28/h2-12,25H,1H3