[4-(5-chloranyl-2-methoxy-phenyl)carbonylpiperazin-1-yl]-(5-nitrothiophen-2-yl)methanone

Systemtic Name: [4-(5-chloranyl-2-methoxy-phenyl)carbonylpiperazin-1-yl]-(5-nitrothiophen-2-yl)methanone Openeye Name: [4-(5-chloro-2-methoxy-benzoyl)piperazin-1-yl]-(5-nitro-2-thienyl)methanone CAS Name: [4-[(5-chloro-2-methoxyphenyl)-oxomethyl]-1-piperazinyl]-(5-nitro-2-thiophenyl)methanone IUPAC Name: [4-(5-chloro-2-methoxybenzoyl)piperazin-1-yl]-(5-nitrothiophen-2-yl)methanone Traditional Name: [4-(5-chloro-2-methoxy-benzoyl)piperazino]-(5-nitro-2-thienyl)methanone Formula: C17H16ClN3O5S MolecularWeight: 409.84404

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C(=O)N2CCN(CC2)C(=O)C3=CC=C(S3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C(=O)N2CCN(CC2)C(=O)C3=CC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C17H16ClN3O5S/c1-26-13-3-2-11(18)10-12(13)16(22)19-6-8-20(9-7-19)17(23)14-4-5-15(27-14)21(24)25/h2-5,10H,6-9H2,1H3