3-(1,3-benzothiazol-2-yl)-7-(dioctylamino)chromen-2-one

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-7-(dioctylamino)chromen-2-one Openeye Name: 3-(1,3-benzothiazol-2-yl)-7-(dioctylamino)chromen-2-one CAS Name: 3-(1,3-benzothiazol-2-yl)-7-(dioctylamino)-1-benzopyran-2-one IUPAC Name: 3-(1,3-benzothiazol-2-yl)-7-(dioctylamino)chromen-2-one Traditional Name: 3-(1,3-benzothiazol-2-yl)-7-(dioctylamino)coumarin Formula: C32H42N2O2S MolecularWeight: 518.75308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN(CCCCCCCC)C1=CC2=C(C=C1)C=C(C(=O)O2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCCCCCCCN(CCCCCCCC)C1=CC2=C(C=C1)C=C(C(=O)O2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C32H42N2O2S/c1-3-5-7-9-11-15-21-34(22-16-12-10-8-6-4-2)26-20-19-25-23-27(32(35)36-29(25)24-26)31-33-28-17-13-14-18-30(28)37-31/h13-14,17-20,23-24H,3-12,15-16,21-22H2,1-2H3