3-chloranyl-N-[2-(4-methoxyphenyl)ethyl]-6-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[2-(4-methoxyphenyl)ethyl]-6-nitro-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[2-(4-methoxyphenyl)ethyl]-6-nitro-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[2-(4-methoxyphenyl)ethyl]-6-nitro-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[2-(4-methoxyphenyl)ethyl]-6-nitro-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[2-(4-methoxyphenyl)ethyl]-6-nitro-benzothiophene-2-carboxamide Formula: C18H15ClN2O4S MolecularWeight: 390.8407

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=O)C2=C(C3=C(S2)C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=O)C2=C(C3=C(S2)C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H15ClN2O4S/c1-25-13-5-2-11(3-6-13)8-9-20-18(22)17-16(19)14-7-4-12(21(23)24)10-15(14)26-17/h2-7,10H,8-9H2,1H3,(H,20,22)