[4-[4-[2-(4-nitrophenyl)ethyl]piperazin-1-yl]-1-benzothiophen-2-yl]methanol

Systemtic Name: [4-[4-[2-(4-nitrophenyl)ethyl]piperazin-1-yl]-1-benzothiophen-2-yl]methanol Openeye Name: [4-[4-[2-(4-nitrophenyl)ethyl]piperazin-1-yl]benzothiophen-2-yl]methanol CAS Name: [4-[4-[2-(4-nitrophenyl)ethyl]-1-piperazinyl]-1-benzothiophen-2-yl]methanol IUPAC Name: [4-[4-[2-(4-nitrophenyl)ethyl]piperazin-1-yl]-1-benzothiophen-2-yl]methanol Traditional Name: [4-[4-[2-(4-nitrophenyl)ethyl]piperazino]benzothiophen-2-yl]methanol Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC=C(C=C2)[N+](=O)[O-])C3=C4C=C(SC4=CC=C3)CO

Isomeric SMILES

C1CN(CCN1CCC2=CC=C(C=C2)[N+](=O)[O-])C3=C4C=C(SC4=CC=C3)CO

InChI

InChI=1S/C21H23N3O3S/c25-15-18-14-19-20(2-1-3-21(19)28-18)23-12-10-22(11-13-23)9-8-16-4-6-17(7-5-16)24(26)27/h1-7,14,25H,8-13,15H2