(4-nitrophenyl) 2-(5-chloranyl-3-methyl-1-benzothiophen-2-yl)ethanoate

Systemtic Name: (4-nitrophenyl) 2-(5-chloranyl-3-methyl-1-benzothiophen-2-yl)ethanoate Openeye Name: (4-nitrophenyl) 2-(5-chloro-3-methyl-benzothiophen-2-yl)acetate CAS Name: 2-(5-chloro-3-methyl-1-benzothiophen-2-yl)acetic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 2-(5-chloro-3-methyl-1-benzothiophen-2-yl)acetate Traditional Name: 2-(5-chloro-3-methyl-benzothiophen-2-yl)acetic acid (4-nitrophenyl) ester Formula: C17H12ClNO4S MolecularWeight: 361.79948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=C(C=C2)Cl)CC(=O)OC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(SC2=C1C=C(C=C2)Cl)CC(=O)OC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H12ClNO4S/c1-10-14-8-11(18)2-7-15(14)24-16(10)9-17(20)23-13-5-3-12(4-6-13)19(21)22/h2-8H,9H2,1H3