7-(4-nitrophenyl)carbonyl-4,5,6,7-tetrahydrothieno[3,2-b]azepin-8-one

Systemtic Name: 7-(4-nitrophenyl)carbonyl-4,5,6,7-tetrahydrothieno[3,2-b]azepin-8-one Openeye Name: 7-(4-nitrobenzoyl)-4,5,6,7-tetrahydrothieno[3,2-b]azepin-8-one CAS Name: 7-[(4-nitrophenyl)-oxomethyl]-4,5,6,7-tetrahydrothieno[3,2-b]azepin-8-one IUPAC Name: 7-(4-nitrobenzoyl)-4,5,6,7-tetrahydrothieno[3,2-b]azepin-8-one Traditional Name: 7-(4-nitrobenzoyl)-4,5,6,7-tetrahydrothien[3,2-b]azepin-8-one Formula: C15H12N2O4S MolecularWeight: 316.33178

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC2=C(C(=O)C1C(=O)C3=CC=C(C=C3)[N+](=O)[O-])SC=C2

Isomeric SMILES

C1CNC2=C(C(=O)C1C(=O)C3=CC=C(C=C3)[N+](=O)[O-])SC=C2

InChI

InChI=1S/C15H12N2O4S/c18-13(9-1-3-10(4-2-9)17(20)21)11-5-7-16-12-6-8-22-15(12)14(11)19/h1-4,6,8,11,16H,5,7H2