N-[(3E)-3-(5-methyl-3H-1,3-benzoxazol-2-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]-2-nitro-benzamide

Systemtic Name: N-[(3E)-3-(5-methyl-3H-1,3-benzoxazol-2-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]-2-nitro-benzamide Openeye Name: N-[(3E)-3-(5-methyl-3H-1,3-benzoxazol-2-ylidene)-4-oxo-cyclohexa-1,5-dien-1-yl]-2-nitro-benzamide CAS Name: N-[(3E)-3-(5-methyl-3H-1,3-benzoxazol-2-ylidene)-4-oxo-1-cyclohexa-1,5-dienyl]-2-nitrobenzamide IUPAC Name: N-[(3E)-3-(5-methyl-3H-1,3-benzoxazol-2-ylidene)-4-oxocyclohexa-1,5-dien-1-yl]-2-nitrobenzamide Traditional Name: N-[(3E)-4-keto-3-(5-methyl-3H-1,3-benzoxazol-2-ylidene)cyclohexa-1,5-dien-1-yl]-2-nitro-benzamide Formula: C21H15N3O5 MolecularWeight: 389.3609

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=C3C=C(C=CC3=O)NC(=O)C4=CC=CC=C4[N+](=O)[O-])N2

Isomeric SMILES

CC1=CC2=C(C=C1)O/C(=C/3\C=C(C=CC3=O)NC(=O)C4=CC=CC=C4[N+](=O)[O-])/N2

InChI

InChI=1S/C21H15N3O5/c1-12-6-9-19-16(10-12)23-21(29-19)15-11-13(7-8-18(15)25)22-20(26)14-4-2-3-5-17(14)24(27)28/h2-11,23H,1H3,(H,22,26)/b21-15+