ethyl 2-[4-(1,3-benzothiazol-2-yl)-2-bromanyl-6-methoxy-phenoxy]ethanoate

Systemtic Name: ethyl 2-[4-(1,3-benzothiazol-2-yl)-2-bromanyl-6-methoxy-phenoxy]ethanoate Openeye Name: ethyl 2-[4-(1,3-benzothiazol-2-yl)-2-bromo-6-methoxy-phenoxy]acetate CAS Name: 2-[4-(1,3-benzothiazol-2-yl)-2-bromo-6-methoxyphenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(1,3-benzothiazol-2-yl)-2-bromo-6-methoxyphenoxy]acetate Traditional Name: 2-[4-(1,3-benzothiazol-2-yl)-2-bromo-6-methoxy-phenoxy]acetic acid ethyl ester Formula: C18H16BrNO4S MolecularWeight: 422.29294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=C(C=C(C=C1Br)C2=NC3=CC=CC=C3S2)OC

Isomeric SMILES

CCOC(=O)COC1=C(C=C(C=C1Br)C2=NC3=CC=CC=C3S2)OC

InChI

InChI=1S/C18H16BrNO4S/c1-3-23-16(21)10-24-17-12(19)8-11(9-14(17)22-2)18-20-13-6-4-5-7-15(13)25-18/h4-9H,3,10H2,1-2H3