[3-(1,3-benzothiazol-2-yl)-6-ethyl-4-oxidanylidene-2-propan-2-yl-chromen-7-yl] 3,4-dimethoxybenzoate

Systemtic Name: [3-(1,3-benzothiazol-2-yl)-6-ethyl-4-oxidanylidene-2-propan-2-yl-chromen-7-yl] 3,4-dimethoxybenzoate Openeye Name: [3-(1,3-benzothiazol-2-yl)-6-ethyl-2-isopropyl-4-oxo-chromen-7-yl] 3,4-dimethoxybenzoate CAS Name: 3,4-dimethoxybenzoic acid [3-(1,3-benzothiazol-2-yl)-6-ethyl-4-oxo-2-propan-2-yl-1-benzopyran-7-yl] ester IUPAC Name: [3-(1,3-benzothiazol-2-yl)-6-ethyl-4-oxo-2-propan-2-ylchromen-7-yl] 3,4-dimethoxybenzoate Traditional Name: 3,4-dimethoxybenzoic acid [3-(1,3-benzothiazol-2-yl)-6-ethyl-2-isopropyl-4-keto-chromen-7-yl] ester Formula: C30H27NO6S MolecularWeight: 529.60348

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C(C)C)C3=NC4=CC=CC=C4S3)OC(=O)C5=CC(=C(C=C5)OC)OC

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C(C)C)C3=NC4=CC=CC=C4S3)OC(=O)C5=CC(=C(C=C5)OC)OC

InChI

InChI=1S/C30H27NO6S/c1-6-17-13-19-23(15-22(17)37-30(33)18-11-12-21(34-4)24(14-18)35-5)36-28(16(2)3)26(27(19)32)29-31-20-9-7-8-10-25(20)38-29/h7-16H,6H2,1-5H3