[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-[3-(thiophen-2-ylmethoxy)phenyl]methanone

Systemtic Name: [4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-[3-(thiophen-2-ylmethoxy)phenyl]methanone Openeye Name: [4-(4-chloro-2-nitro-phenyl)piperazin-1-yl]-[3-(2-thienylmethoxy)phenyl]methanone CAS Name: [4-(4-chloro-2-nitrophenyl)-1-piperazinyl]-[3-(thiophen-2-ylmethoxy)phenyl]methanone IUPAC Name: [4-(4-chloro-2-nitrophenyl)piperazin-1-yl]-[3-(thiophen-2-ylmethoxy)phenyl]methanone Traditional Name: [4-(4-chloro-2-nitro-phenyl)piperazino]-[3-(2-thenyloxy)phenyl]methanone Formula: C22H20ClN3O4S MolecularWeight: 457.9299

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)Cl)[N+](=O)[O-])C(=O)C3=CC(=CC=C3)OCC4=CC=CS4

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)Cl)[N+](=O)[O-])C(=O)C3=CC(=CC=C3)OCC4=CC=CS4

InChI

InChI=1S/C22H20ClN3O4S/c23-17-6-7-20(21(14-17)26(28)29)24-8-10-25(11-9-24)22(27)16-3-1-4-18(13-16)30-15-19-5-2-12-31-19/h1-7,12-14H,8-11,15H2