4-[(4-chloranyl-3-nitro-phenyl)methylideneamino]-6-(5,7-dimethyl-3H-1,3-benzoxazol-2-ylidene)cyclohexa-2,4-dien-1-one

Systemtic Name: 4-[(4-chloranyl-3-nitro-phenyl)methylideneamino]-6-(5,7-dimethyl-3H-1,3-benzoxazol-2-ylidene)cyclohexa-2,4-dien-1-one Openeye Name: 4-[(4-chloro-3-nitro-phenyl)methyleneamino]-6-(5,7-dimethyl-3H-1,3-benzoxazol-2-ylidene)cyclohexa-2,4-dien-1-one CAS Name: 4-[(4-chloro-3-nitrophenyl)methylideneamino]-6-(5,7-dimethyl-3H-1,3-benzoxazol-2-ylidene)-1-cyclohexa-2,4-dienone IUPAC Name: 4-[(4-chloro-3-nitrophenyl)methylideneamino]-6-(5,7-dimethyl-3H-1,3-benzoxazol-2-ylidene)cyclohexa-2,4-dien-1-one Traditional Name: 4-[(4-chloro-3-nitro-benzylidene)amino]-6-(5,7-dimethyl-3H-1,3-benzoxazol-2-ylidene)cyclohexa-2,4-dien-1-one Formula: C22H16ClN3O4 MolecularWeight: 421.83314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)NC(=C3C=C(C=CC3=O)N=CC4=CC(=C(C=C4)Cl)[N+](=O)[O-])O2)C

Isomeric SMILES

CC1=CC(=C2C(=C1)NC(=C3C=C(C=CC3=O)N=CC4=CC(=C(C=C4)Cl)[N+](=O)[O-])O2)C

InChI

InChI=1S/C22H16ClN3O4/c1-12-7-13(2)21-18(8-12)25-22(30-21)16-10-15(4-6-20(16)27)24-11-14-3-5-17(23)19(9-14)26(28)29/h3-11,25H,1-2H3