2-[4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl]-1,3-benzothiazole

Systemtic Name: 2-[4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl]-1,3-benzothiazole Openeye Name: 2-[4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl]-1,3-benzothiazole CAS Name: 2-[4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl]-1,3-benzothiazole IUPAC Name: 2-[4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl]-1,3-benzothiazole Traditional Name: 2-[4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl]-1,3-benzothiazole Formula: C21H16N2O4S MolecularWeight: 392.42774

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3S2)COC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3S2)COC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H16N2O4S/c1-26-19-11-6-14(21-22-18-4-2-3-5-20(18)28-21)12-15(19)13-27-17-9-7-16(8-10-17)23(24)25/h2-12H,13H2,1H3