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

Systemtic Name: 2-[2-[4-(3-methylbutoxy)phenyl]ethenyl]-6-nitro-1,3-benzothiazole Openeye Name: 2-[2-(4-isopentyloxyphenyl)vinyl]-6-nitro-1,3-benzothiazole CAS Name: 2-[2-[4-(3-methylbutoxy)phenyl]ethenyl]-6-nitro-1,3-benzothiazole IUPAC Name: 2-[2-[4-(3-methylbutoxy)phenyl]ethenyl]-6-nitro-1,3-benzothiazole Traditional Name: 2-[2-(4-isoamoxyphenyl)vinyl]-6-nitro-1,3-benzothiazole Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C=CC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)C=CC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H20N2O3S/c1-14(2)11-12-25-17-7-3-15(4-8-17)5-10-20-21-18-9-6-16(22(23)24)13-19(18)26-20/h3-10,13-14H,11-12H2,1-2H3