ethyl 3-(1,3-benzothiazol-2-yl)-6-[[bis(2-hydroxyethyl)amino]methyl]-8-methyl-7-oxidanyl-4-oxidanylidene-chromene-2-carboxylate

Systemtic Name: ethyl 3-(1,3-benzothiazol-2-yl)-6-[[bis(2-hydroxyethyl)amino]methyl]-8-methyl-7-oxidanyl-4-oxidanylidene-chromene-2-carboxylate Openeye Name: ethyl 3-(1,3-benzothiazol-2-yl)-6-[[bis(2-hydroxyethyl)amino]methyl]-7-hydroxy-8-methyl-4-oxo-chromene-2-carboxylate CAS Name: 3-(1,3-benzothiazol-2-yl)-6-[[bis(2-hydroxyethyl)amino]methyl]-7-hydroxy-8-methyl-4-oxo-1-benzopyran-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(1,3-benzothiazol-2-yl)-6-[[bis(2-hydroxyethyl)amino]methyl]-7-hydroxy-8-methyl-4-oxochromene-2-carboxylate Traditional Name: 3-(1,3-benzothiazol-2-yl)-6-[[bis(2-hydroxyethyl)amino]methyl]-7-hydroxy-4-keto-8-methyl-chromene-2-carboxylic acid ethyl ester Formula: C25H26N2O7S MolecularWeight: 498.54814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)C2=CC(=C(C(=C2O1)C)O)CN(CCO)CCO)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCOC(=O)C1=C(C(=O)C2=CC(=C(C(=C2O1)C)O)CN(CCO)CCO)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C25H26N2O7S/c1-3-33-25(32)23-19(24-26-17-6-4-5-7-18(17)35-24)21(31)16-12-15(13-27(8-10-28)9-11-29)20(30)14(2)22(16)34-23/h4-7,12,28-30H,3,8-11,13H2,1-2H3