4-[2-(3,4,5,6-tetrahydro-2H-azepin-7-yl)hydrazinyl]benzenesulfonic acid

Systemtic Name: 4-[2-(3,4,5,6-tetrahydro-2H-azepin-7-yl)hydrazinyl]benzenesulfonic acid Openeye Name: 4-[2-(3,4,5,6-tetrahydro-2H-azepin-7-yl)hydrazino]benzenesulfonic acid CAS Name: 4-(3,4,5,6-tetrahydro-2H-azepin-7-ylhydrazo)benzenesulfonic acid IUPAC Name: 4-[2-(3,4,5,6-tetrahydro-2H-azepin-7-yl)hydrazinyl]benzenesulfonic acid Traditional Name: 4-[N'-(3,4,5,6-tetrahydro-2H-azepin-7-yl)hydrazino]besylic acid Formula: C12H17N3O3S MolecularWeight: 283.34668

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=NCC1)NNC2=CC=C(C=C2)S(=O)(=O)O

Isomeric SMILES

C1CCC(=NCC1)NNC2=CC=C(C=C2)S(=O)(=O)O

InChI

InChI=1S/C12H17N3O3S/c16-19(17,18)11-7-5-10(6-8-11)14-15-12-4-2-1-3-9-13-12/h5-8,14H,1-4,9H2,(H,13,15)(H,16,17,18)