2-[[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]iminomethyl]-6-methyl-4-nitro-phenolate

Systemtic Name: 2-[[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]iminomethyl]-6-methyl-4-nitro-phenolate Openeye Name: 2-[[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]iminomethyl]-6-methyl-4-nitro-phenolate CAS Name: 2-[[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]iminomethyl]-6-methyl-4-nitrophenolate IUPAC Name: 2-[[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]iminomethyl]-6-methyl-4-nitrophenolate Traditional Name: 2-[[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]iminomethyl]-6-methyl-4-nitro-phenolate Formula: C23H18N3O4- MolecularWeight: 400.40672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)N=C(O2)C3=CC(=CC=C3)N=CC4=CC(=CC(=C4[O-])C)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C2C(=C1)N=C(O2)C3=CC(=CC=C3)N=CC4=CC(=CC(=C4[O-])C)[N+](=O)[O-])C

InChI

InChI=1S/C23H19N3O4/c1-13-7-15(3)22-20(8-13)25-23(30-22)16-5-4-6-18(10-16)24-12-17-11-19(26(28)29)9-14(2)21(17)27/h4-12,27H,1-3H3/p-1