4-[[3-(3H-1,3-benzoxazol-2-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]amino]-3-nitro-chromen-2-one

Systemtic Name: 4-[[3-(3H-1,3-benzoxazol-2-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]amino]-3-nitro-chromen-2-one Openeye Name: 4-[[3-(3H-1,3-benzoxazol-2-ylidene)-4-oxo-cyclohexa-1,5-dien-1-yl]amino]-3-nitro-chromen-2-one CAS Name: 4-[[3-(3H-1,3-benzoxazol-2-ylidene)-4-oxo-1-cyclohexa-1,5-dienyl]amino]-3-nitro-1-benzopyran-2-one IUPAC Name: 4-[[3-(3H-1,3-benzoxazol-2-ylidene)-4-oxocyclohexa-1,5-dien-1-yl]amino]-3-nitrochromen-2-one Traditional Name: 4-[[3-(3H-1,3-benzoxazol-2-ylidene)-4-keto-cyclohexa-1,5-dien-1-yl]amino]-3-nitro-coumarin Formula: C22H13N3O6 MolecularWeight: 415.35512

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(C(=O)O2)[N+](=O)[O-])NC3=CC(=C4NC5=CC=CC=C5O4)C(=O)C=C3

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(C(=O)O2)[N+](=O)[O-])NC3=CC(=C4NC5=CC=CC=C5O4)C(=O)C=C3

InChI

InChI=1S/C22H13N3O6/c26-16-10-9-12(11-14(16)21-24-15-6-2-4-8-18(15)30-21)23-19-13-5-1-3-7-17(13)31-22(27)20(19)25(28)29/h1-11,23-24H