3-chloranyl-N-(4-morpholin-4-ylphenyl)-7-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-(4-morpholin-4-ylphenyl)-7-nitro-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-(4-morpholinophenyl)-7-nitro-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[4-(4-morpholinyl)phenyl]-7-nitro-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-(4-morpholin-4-ylphenyl)-7-nitro-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-(4-morpholinophenyl)-7-nitro-benzothiophene-2-carboxamide Formula: C19H16ClN3O4S MolecularWeight: 417.86604

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)NC(=O)C3=C(C4=C(S3)C(=CC=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)NC(=O)C3=C(C4=C(S3)C(=CC=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H16ClN3O4S/c20-16-14-2-1-3-15(23(25)26)17(14)28-18(16)19(24)21-12-4-6-13(7-5-12)22-8-10-27-11-9-22/h1-7H,8-11H2,(H,21,24)