2-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)ethanamine

Systemtic Name: 2-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)ethanamine Openeye Name: 2-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)ethanamine CAS Name: 2-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)ethanamine IUPAC Name: 2-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)ethanamine Traditional Name: 2-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)ethylamine Formula: C10H11N3O3S MolecularWeight: 253.27764

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1)[N+](=O)[O-])SC(=N2)CCN

Isomeric SMILES

COC1=C2C(=CC(=C1)[N+](=O)[O-])SC(=N2)CCN

InChI

InChI=1S/C10H11N3O3S/c1-16-7-4-6(13(14)15)5-8-10(7)12-9(17-8)2-3-11/h4-5H,2-3,11H2,1H3