[4-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]phenyl]sulfamic acid

Systemtic Name: [4-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]phenyl]sulfamic acid Openeye Name: [4-[4-(1-naphthylmethyl)piperazin-1-yl]phenyl]sulfamic acid CAS Name: [4-[4-(1-naphthalenylmethyl)-1-piperazinyl]phenyl]sulfamic acid IUPAC Name: [4-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]phenyl]sulfamic acid Traditional Name: [4-[4-(1-naphthylmethyl)piperazino]phenyl]sulfamic acid Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC3=CC=CC=C32)C4=CC=C(C=C4)NS(=O)(=O)O

Isomeric SMILES

C1CN(CCN1CC2=CC=CC3=CC=CC=C32)C4=CC=C(C=C4)NS(=O)(=O)O

InChI

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