2-[(Z)-1-chloranyl-2-(3-nitro-4-propan-2-yl-phenyl)ethenyl]-1,3-benzothiazole

Systemtic Name: 2-[(Z)-1-chloranyl-2-(3-nitro-4-propan-2-yl-phenyl)ethenyl]-1,3-benzothiazole Openeye Name: 2-[(Z)-1-chloro-2-(4-isopropyl-3-nitro-phenyl)vinyl]-1,3-benzothiazole CAS Name: 2-[(Z)-1-chloro-2-(3-nitro-4-propan-2-ylphenyl)ethenyl]-1,3-benzothiazole IUPAC Name: 2-[(Z)-1-chloro-2-(3-nitro-4-propan-2-ylphenyl)ethenyl]-1,3-benzothiazole Traditional Name: 2-[(Z)-1-chloro-2-(4-isopropyl-3-nitro-phenyl)vinyl]-1,3-benzothiazole Formula: C18H15ClN2O2S MolecularWeight: 358.8419

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=C(C=C1)C=C(C2=NC3=CC=CC=C3S2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=C(C=C(C=C1)/C=C(/C2=NC3=CC=CC=C3S2)\Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H15ClN2O2S/c1-11(2)13-8-7-12(10-16(13)21(22)23)9-14(19)18-20-15-5-3-4-6-17(15)24-18/h3-11H,1-2H3/b14-9-