4-(4-nitrocyclohexa-1,5-dien-1-yl)sulfonylbutan-1-amine

Systemtic Name: 4-(4-nitrocyclohexa-1,5-dien-1-yl)sulfonylbutan-1-amine Openeye Name: 4-(4-nitrocyclohexa-1,5-dien-1-yl)sulfonylbutan-1-amine CAS Name: 4-[(4-nitro-1-cyclohexa-1,5-dienyl)sulfonyl]-1-butanamine IUPAC Name: 4-(4-nitrocyclohexa-1,5-dien-1-yl)sulfonylbutan-1-amine Traditional Name: 4-(4-nitrocyclohexa-1,5-dien-1-yl)sulfonylbutylamine Formula: C10H16N2O4S MolecularWeight: 260.31004

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(C=CC1[N+](=O)[O-])S(=O)(=O)CCCCN

Isomeric SMILES

C1C=C(C=CC1[N+](=O)[O-])S(=O)(=O)CCCCN

InChI

InChI=1S/C10H16N2O4S/c11-7-1-2-8-17(15,16)10-5-3-9(4-6-10)12(13)14/h3,5-6,9H,1-2,4,7-8,11H2