4-[(4-butoxyphenyl)carbonylamino]-2-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenolate

Systemtic Name: 4-[(4-butoxyphenyl)carbonylamino]-2-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenolate Openeye Name: 4-[(4-butoxybenzoyl)amino]-2-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenolate CAS Name: 4-[[(4-butoxyphenyl)-oxomethyl]amino]-2-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenolate IUPAC Name: 4-[(4-butoxybenzoyl)amino]-2-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenolate Traditional Name: 4-[(4-butoxybenzoyl)amino]-2-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenolate Formula: C26H25N2O4- MolecularWeight: 429.4877

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)[O-])C3=NC4=CC(=CC(=C4O3)C)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)[O-])C3=NC4=CC(=CC(=C4O3)C)C

InChI

InChI=1S/C26H26N2O4/c1-4-5-12-31-20-9-6-18(7-10-20)25(30)27-19-8-11-23(29)21(15-19)26-28-22-14-16(2)13-17(3)24(22)32-26/h6-11,13-15,29H,4-5,12H2,1-3H3,(H,27,30)/p-1