5-[(E)-2-(3-chloranyl-1-benzothiophen-2-yl)ethenyl]-3-methyl-4-nitro-1,2-oxazole

Systemtic Name: 5-[(E)-2-(3-chloranyl-1-benzothiophen-2-yl)ethenyl]-3-methyl-4-nitro-1,2-oxazole Openeye Name: 5-[(E)-2-(3-chlorobenzothiophen-2-yl)vinyl]-3-methyl-4-nitro-isoxazole CAS Name: 5-[(E)-2-(3-chloro-1-benzothiophen-2-yl)ethenyl]-3-methyl-4-nitroisoxazole IUPAC Name: 5-[(E)-2-(3-chloro-1-benzothiophen-2-yl)ethenyl]-3-methyl-4-nitro-1,2-oxazole Traditional Name: 5-[(E)-2-(3-chlorobenzothiophen-2-yl)vinyl]-3-methyl-4-nitro-isoxazole Formula: C14H9ClN2O3S MolecularWeight: 320.75086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1[N+](=O)[O-])C=CC2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

CC1=NOC(=C1[N+](=O)[O-])/C=C/C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C14H9ClN2O3S/c1-8-14(17(18)19)10(20-16-8)6-7-12-13(15)9-4-2-3-5-11(9)21-12/h2-7H,1H3/b7-6+