methyl 2-[2-(2-methoxyphenyl)carbonyliminobenzo[g][1,3]benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[2-(2-methoxyphenyl)carbonyliminobenzo[g][1,3]benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[2-(2-methoxybenzoyl)iminobenzo[g][1,3]benzothiazol-3-yl]acetate CAS Name: 2-[2-[(2-methoxyphenyl)-oxomethyl]imino-3-benzo[g][1,3]benzothiazolyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(2-methoxybenzoyl)iminobenzo[g][1,3]benzothiazol-3-yl]acetate Traditional Name: 2-(2-o-anisoyliminobenzo[g][1,3]benzothiazol-3-yl)acetic acid methyl ester Formula: C22H18N2O4S MolecularWeight: 406.45432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)N=C2N(C3=C(S2)C4=CC=CC=C4C=C3)CC(=O)OC

Isomeric SMILES

COC1=CC=CC=C1C(=O)N=C2N(C3=C(S2)C4=CC=CC=C4C=C3)CC(=O)OC

InChI

InChI=1S/C22H18N2O4S/c1-27-18-10-6-5-9-16(18)21(26)23-22-24(13-19(25)28-2)17-12-11-14-7-3-4-8-15(14)20(17)29-22/h3-12H,13H2,1-2H3