2-[2-[3,4-bis(phenylmethoxy)phenyl]ethenyl]-6-nitro-1,3-benzothiazole

Systemtic Name: 2-[2-[3,4-bis(phenylmethoxy)phenyl]ethenyl]-6-nitro-1,3-benzothiazole Openeye Name: 2-[2-(3,4-dibenzyloxyphenyl)vinyl]-6-nitro-1,3-benzothiazole CAS Name: 2-[2-[3,4-bis(phenylmethoxy)phenyl]ethenyl]-6-nitro-1,3-benzothiazole IUPAC Name: 2-[2-[3,4-bis(phenylmethoxy)phenyl]ethenyl]-6-nitro-1,3-benzothiazole Traditional Name: 2-[2-(3,4-dibenzoxyphenyl)vinyl]-6-nitro-1,3-benzothiazole Formula: C29H22N2O4S MolecularWeight: 494.56098

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C=CC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-])OCC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C=CC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-])OCC5=CC=CC=C5

InChI

InChI=1S/C29H22N2O4S/c32-31(33)24-13-14-25-28(18-24)36-29(30-25)16-12-21-11-15-26(34-19-22-7-3-1-4-8-22)27(17-21)35-20-23-9-5-2-6-10-23/h1-18H,19-20H2