(3-chloranyl-1-benzothiophen-2-yl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: (3-chloranyl-1-benzothiophen-2-yl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone Openeye Name: (3-chlorobenzothiophen-2-yl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone CAS Name: (3-chloro-1-benzothiophen-2-yl)-[4-(2-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: (3-chloro-1-benzothiophen-2-yl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone Traditional Name: (3-chlorobenzothiophen-2-yl)-[4-(2-nitrophenyl)piperazino]methanone Formula: C19H16ClN3O3S MolecularWeight: 401.86664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2[N+](=O)[O-])C(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2[N+](=O)[O-])C(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C19H16ClN3O3S/c20-17-13-5-1-4-8-16(13)27-18(17)19(24)22-11-9-21(10-12-22)14-6-2-3-7-15(14)23(25)26/h1-8H,9-12H2