2-(5,7-dimethyl-1,3-benzoxazol-2-yl)-4-[(5-methoxy-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]phenolate

Systemtic Name: 2-(5,7-dimethyl-1,3-benzoxazol-2-yl)-4-[(5-methoxy-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]phenolate Openeye Name: 2-(5,7-dimethyl-1,3-benzoxazol-2-yl)-4-[(5-methoxy-3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]phenolate CAS Name: 2-(5,7-dimethyl-1,3-benzoxazol-2-yl)-4-[(5-methoxy-3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]phenolate IUPAC Name: 2-(5,7-dimethyl-1,3-benzoxazol-2-yl)-4-[(5-methoxy-3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]phenolate Traditional Name: 2-(5,7-dimethyl-1,3-benzoxazol-2-yl)-4-[(6-keto-5-methoxy-3-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]phenolate Formula: C23H18N3O6- MolecularWeight: 432.40552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)N=C(O2)C3=C(C=CC(=C3)NC=C4C=C(C=C(C4=O)OC)[N+](=O)[O-])[O-])C

Isomeric SMILES

CC1=CC(=C2C(=C1)N=C(O2)C3=C(C=CC(=C3)NC=C4C=C(C=C(C4=O)OC)[N+](=O)[O-])[O-])C

InChI

InChI=1S/C23H19N3O6/c1-12-6-13(2)22-18(7-12)25-23(32-22)17-9-15(4-5-19(17)27)24-11-14-8-16(26(29)30)10-20(31-3)21(14)28/h4-11,24,27H,1-3H3/p-1