2-acetamido-3-[4-[2-[2-oxidanylidene-6-(phenylcarbonyl)-1,3-benzothiazol-3-yl]ethoxy]phenyl]propanoate

Systemtic Name: 2-acetamido-3-[4-[2-[2-oxidanylidene-6-(phenylcarbonyl)-1,3-benzothiazol-3-yl]ethoxy]phenyl]propanoate Openeye Name: 2-acetamido-3-[4-[2-(6-benzoyl-2-oxo-1,3-benzothiazol-3-yl)ethoxy]phenyl]propanoate CAS Name: 2-acetamido-3-[4-[2-(6-benzoyl-2-oxo-1,3-benzothiazol-3-yl)ethoxy]phenyl]propanoate IUPAC Name: 2-acetamido-3-[4-[2-(6-benzoyl-2-oxo-1,3-benzothiazol-3-yl)ethoxy]phenyl]propanoate Traditional Name: 2-acetamido-3-[4-[2-(6-benzoyl-2-keto-1,3-benzothiazol-3-yl)ethoxy]phenyl]propionate Formula: C27H23N2O6S- MolecularWeight: 503.54632

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CC=C(C=C1)OCCN2C3=C(C=C(C=C3)C(=O)C4=CC=CC=C4)SC2=O)C(=O)[O-]

Isomeric SMILES

CC(=O)NC(CC1=CC=C(C=C1)OCCN2C3=C(C=C(C=C3)C(=O)C4=CC=CC=C4)SC2=O)C(=O)[O-]

InChI

InChI=1S/C27H24N2O6S/c1-17(30)28-22(26(32)33)15-18-7-10-21(11-8-18)35-14-13-29-23-12-9-20(16-24(23)36-27(29)34)25(31)19-5-3-2-4-6-19/h2-12,16,22H,13-15H2,1H3,(H,28,30)(H,32,33)/p-1