methyl 2-[6-chloranyl-2-[(7-ethoxy-1-benzofuran-2-yl)carbonylimino]-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[6-chloranyl-2-[(7-ethoxy-1-benzofuran-2-yl)carbonylimino]-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[6-chloro-2-(7-ethoxybenzofuran-2-carbonyl)imino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[6-chloro-2-[(7-ethoxy-2-benzofuranyl)-oxomethyl]imino-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[6-chloro-2-(7-ethoxy-1-benzofuran-2-carbonyl)imino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[6-chloro-2-(7-ethoxybenzofuran-2-carbonyl)imino-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C21H17ClN2O5S MolecularWeight: 444.88808

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC2=C1OC(=C2)C(=O)N=C3N(C4=C(S3)C=C(C=C4)Cl)CC(=O)OC

Isomeric SMILES

CCOC1=CC=CC2=C1OC(=C2)C(=O)N=C3N(C4=C(S3)C=C(C=C4)Cl)CC(=O)OC

InChI

InChI=1S/C21H17ClN2O5S/c1-3-28-15-6-4-5-12-9-16(29-19(12)15)20(26)23-21-24(11-18(25)27-2)14-8-7-13(22)10-17(14)30-21/h4-10H,3,11H2,1-2H3