1-naphthalen-2-ylsulfonyl-4-[(3-nitrophenyl)methyl]piperazine

Systemtic Name: 1-naphthalen-2-ylsulfonyl-4-[(3-nitrophenyl)methyl]piperazine Openeye Name: 1-(2-naphthylsulfonyl)-4-[(3-nitrophenyl)methyl]piperazine CAS Name: 1-(2-naphthalenylsulfonyl)-4-[(3-nitrophenyl)methyl]piperazine IUPAC Name: 1-naphthalen-2-ylsulfonyl-4-[(3-nitrophenyl)methyl]piperazine Traditional Name: 1-(2-naphthylsulfonyl)-4-(3-nitrobenzyl)piperazine Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CCN1CC2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H21N3O4S/c25-24(26)20-7-3-4-17(14-20)16-22-10-12-23(13-11-22)29(27,28)21-9-8-18-5-1-2-6-19(18)15-21/h1-9,14-15H,10-13,16H2