[4-[(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)carbamoyl]phenyl] ethanoate

Systemtic Name: [4-[(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)carbamoyl]phenyl] ethanoate Openeye Name: [4-[(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)carbamoyl]phenyl] acetate CAS Name: acetic acid [4-[[(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)amino]-oxomethyl]phenyl] ester IUPAC Name: [4-[(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)carbamoyl]phenyl] acetate Traditional Name: acetic acid [4-[(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)carbamoyl]phenyl] ester Formula: C17H13N3O6S MolecularWeight: 387.36662

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)C(=O)NC2=NC3=C(C=C(C=C3S2)[N+](=O)[O-])OC

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)C(=O)NC2=NC3=C(C=C(C=C3S2)[N+](=O)[O-])OC

InChI

InChI=1S/C17H13N3O6S/c1-9(21)26-12-5-3-10(4-6-12)16(22)19-17-18-15-13(25-2)7-11(20(23)24)8-14(15)27-17/h3-8H,1-2H3,(H,18,19,22)