N-(3-methoxypropyl)-4-nitro-1,3-benzothiazol-5-amine

Systemtic Name: N-(3-methoxypropyl)-4-nitro-1,3-benzothiazol-5-amine Openeye Name: N-(3-methoxypropyl)-4-nitro-1,3-benzothiazol-5-amine CAS Name: N-(3-methoxypropyl)-4-nitro-1,3-benzothiazol-5-amine IUPAC Name: N-(3-methoxypropyl)-4-nitro-1,3-benzothiazol-5-amine Traditional Name: 3-methoxypropyl-(4-nitro-1,3-benzothiazol-5-yl)amine Formula: C11H13N3O3S MolecularWeight: 267.30422

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC1=C(C2=C(C=C1)SC=N2)[N+](=O)[O-]

Isomeric SMILES

COCCCNC1=C(C2=C(C=C1)SC=N2)[N+](=O)[O-]

InChI

InChI=1S/C11H13N3O3S/c1-17-6-2-5-12-8-3-4-9-10(13-7-18-9)11(8)14(15)16/h3-4,7,12H,2,5-6H2,1H3