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

Systemtic Name: 4-methyl-N-[(3E)-5-methyl-4-oxidanylidene-3-(5-propan-2-yl-3H-1,3-benzoxazol-2-ylidene)cyclohexa-1,5-dien-1-yl]-3-nitro-benzamide Openeye Name: N-[(3E)-3-(5-isopropyl-3H-1,3-benzoxazol-2-ylidene)-5-methyl-4-oxo-cyclohexa-1,5-dien-1-yl]-4-methyl-3-nitro-benzamide CAS Name: 4-methyl-N-[(3E)-5-methyl-4-oxo-3-(5-propan-2-yl-3H-1,3-benzoxazol-2-ylidene)-1-cyclohexa-1,5-dienyl]-3-nitrobenzamide IUPAC Name: 4-methyl-N-[(3E)-5-methyl-4-oxo-3-(5-propan-2-yl-3H-1,3-benzoxazol-2-ylidene)cyclohexa-1,5-dien-1-yl]-3-nitrobenzamide Traditional Name: N-[(3E)-3-(5-isopropyl-3H-1,3-benzoxazol-2-ylidene)-4-keto-5-methyl-cyclohexa-1,5-dien-1-yl]-4-methyl-3-nitro-benzamide Formula: C25H23N3O5 MolecularWeight: 445.46722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC(=C3NC4=C(O3)C=CC(=C4)C(C)C)C(=O)C(=C2)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=C/C(=C\3/NC4=C(O3)C=CC(=C4)C(C)C)/C(=O)C(=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C25H23N3O5/c1-13(2)16-7-8-22-20(10-16)27-25(33-22)19-12-18(9-15(4)23(19)29)26-24(30)17-6-5-14(3)21(11-17)28(31)32/h5-13,27H,1-4H3,(H,26,30)/b25-19+