N-[2-(4-methoxyphenoxy)ethyl]-6-nitro-1,3-benzothiazol-2-amine

Systemtic Name: N-[2-(4-methoxyphenoxy)ethyl]-6-nitro-1,3-benzothiazol-2-amine Openeye Name: N-[2-(4-methoxyphenoxy)ethyl]-6-nitro-1,3-benzothiazol-2-amine CAS Name: N-[2-(4-methoxyphenoxy)ethyl]-6-nitro-1,3-benzothiazol-2-amine IUPAC Name: N-[2-(4-methoxyphenoxy)ethyl]-6-nitro-1,3-benzothiazol-2-amine Traditional Name: 2-(4-methoxyphenoxy)ethyl-(6-nitro-1,3-benzothiazol-2-yl)amine Formula: C16H15N3O4S MolecularWeight: 345.373

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCCNC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)OCCNC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O4S/c1-22-12-3-5-13(6-4-12)23-9-8-17-16-18-14-7-2-11(19(20)21)10-15(14)24-16/h2-7,10H,8-9H2,1H3,(H,17,18)