N-[4-(5,6-dimethyl-1,3-benzoxazol-3-ium-2-yl)-3-oxidanyl-phenyl]benzamide

Systemtic Name: N-[4-(5,6-dimethyl-1,3-benzoxazol-3-ium-2-yl)-3-oxidanyl-phenyl]benzamide Openeye Name: N-[4-(5,6-dimethyl-1,3-benzoxazol-3-ium-2-yl)-3-hydroxy-phenyl]benzamide CAS Name: N-[4-(5,6-dimethyl-1,3-benzoxazol-3-ium-2-yl)-3-hydroxyphenyl]benzamide IUPAC Name: N-[4-(5,6-dimethyl-1,3-benzoxazol-3-ium-2-yl)-3-hydroxyphenyl]benzamide Traditional Name: N-[4-(5,6-dimethyl-1,3-benzoxazol-3-ium-2-yl)-3-hydroxy-phenyl]benzamide Formula: C22H19N2O3+ MolecularWeight: 359.39786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)OC(=[NH+]2)C3=C(C=C(C=C3)NC(=O)C4=CC=CC=C4)O

Isomeric SMILES

CC1=CC2=C(C=C1C)OC(=[NH+]2)C3=C(C=C(C=C3)NC(=O)C4=CC=CC=C4)O

InChI

InChI=1S/C22H18N2O3/c1-13-10-18-20(11-14(13)2)27-22(24-18)17-9-8-16(12-19(17)25)23-21(26)15-6-4-3-5-7-15/h3-12,25H,1-2H3,(H,23,26)/p+1