2-(1,3-benzothiazol-2-yl)-4-[(4-propoxyphenyl)carbonylamino]phenolate

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-4-[(4-propoxyphenyl)carbonylamino]phenolate Openeye Name: 2-(1,3-benzothiazol-2-yl)-4-[(4-propoxybenzoyl)amino]phenolate CAS Name: 2-(1,3-benzothiazol-2-yl)-4-[[oxo-(4-propoxyphenyl)methyl]amino]phenolate IUPAC Name: 2-(1,3-benzothiazol-2-yl)-4-[(4-propoxybenzoyl)amino]phenolate Traditional Name: 2-(1,3-benzothiazol-2-yl)-4-[(4-propoxybenzoyl)amino]phenolate Formula: C23H19N2O3S- MolecularWeight: 403.47356

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)[O-])C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)[O-])C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H20N2O3S/c1-2-13-28-17-10-7-15(8-11-17)22(27)24-16-9-12-20(26)18(14-16)23-25-19-5-3-4-6-21(19)29-23/h3-12,14,26H,2,13H2,1H3,(H,24,27)/p-1