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

Systemtic Name: N-[(4Z)-4-(3H-1,3-benzoxazol-2-ylidene)-3-oxidanylidene-cyclohexa-1,5-dien-1-yl]-4-chloranyl-3-nitro-benzamide Openeye Name: N-[(4Z)-4-(3H-1,3-benzoxazol-2-ylidene)-3-oxo-cyclohexa-1,5-dien-1-yl]-4-chloro-3-nitro-benzamide CAS Name: N-[(4Z)-4-(3H-1,3-benzoxazol-2-ylidene)-3-oxo-1-cyclohexa-1,5-dienyl]-4-chloro-3-nitrobenzamide IUPAC Name: N-[(4Z)-4-(3H-1,3-benzoxazol-2-ylidene)-3-oxocyclohexa-1,5-dien-1-yl]-4-chloro-3-nitrobenzamide Traditional Name: N-[(4Z)-4-(3H-1,3-benzoxazol-2-ylidene)-3-keto-cyclohexa-1,5-dien-1-yl]-4-chloro-3-nitro-benzamide Formula: C20H12ClN3O5 MolecularWeight: 409.77938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC=C2C(=C1)N/C(=C/3\C=CC(=CC3=O)NC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])/O2

InChI

InChI=1S/C20H12ClN3O5/c21-14-8-5-11(9-16(14)24(27)28)19(26)22-12-6-7-13(17(25)10-12)20-23-15-3-1-2-4-18(15)29-20/h1-10,23H,(H,22,26)/b20-13-