[4-[(2-nitrophenoxy)methyl]thiophen-2-yl]-[4-(phenylmethyl)piperazin-1-yl]methanone

Systemtic Name: [4-[(2-nitrophenoxy)methyl]thiophen-2-yl]-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-[4-[(2-nitrophenoxy)methyl]-2-thienyl]methanone CAS Name: [4-[(2-nitrophenoxy)methyl]-2-thiophenyl]-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-[4-[(2-nitrophenoxy)methyl]thiophen-2-yl]methanone Traditional Name: (4-benzylpiperazino)-[4-[(2-nitrophenoxy)methyl]-2-thienyl]methanone Formula: C23H23N3O4S MolecularWeight: 437.51142

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CC(=CS3)COC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CC(=CS3)COC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C23H23N3O4S/c27-23(25-12-10-24(11-13-25)15-18-6-2-1-3-7-18)22-14-19(17-31-22)16-30-21-9-5-4-8-20(21)26(28)29/h1-9,14,17H,10-13,15-16H2