5-[4-(4-ethanoyl-2-nitro-phenyl)piperazin-1-yl]thiophene-2-carbaldehyde

Systemtic Name: 5-[4-(4-ethanoyl-2-nitro-phenyl)piperazin-1-yl]thiophene-2-carbaldehyde Openeye Name: 5-[4-(4-acetyl-2-nitro-phenyl)piperazin-1-yl]thiophene-2-carbaldehyde CAS Name: 5-[4-(4-acetyl-2-nitrophenyl)-1-piperazinyl]-2-thiophenecarboxaldehyde IUPAC Name: 5-[4-(4-acetyl-2-nitrophenyl)piperazin-1-yl]thiophene-2-carbaldehyde Traditional Name: 5-[4-(4-acetyl-2-nitro-phenyl)piperazino]thiophene-2-carbaldehyde Formula: C17H17N3O4S MolecularWeight: 359.39958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O4S/c1-12(22)13-2-4-15(16(10-13)20(23)24)18-6-8-19(9-7-18)17-5-3-14(11-21)25-17/h2-5,10-11H,6-9H2,1H3