4-methyl-7-[3-[22-[3-(4-methyl-2-oxidanylidene-chromen-7-yl)oxypropyl]-1,4,7,16-tetraoxa-13,19-dithia-10,22-diazacyclotetracos-10-yl]propoxy]chromen-2-one

Systemtic Name: 4-methyl-7-[3-[22-[3-(4-methyl-2-oxidanylidene-chromen-7-yl)oxypropyl]-1,4,7,16-tetraoxa-13,19-dithia-10,22-diazacyclotetracos-10-yl]propoxy]chromen-2-one Openeye Name: 4-methyl-7-[3-[22-[3-(4-methyl-2-oxo-chromen-7-yl)oxypropyl]-1,4,7,16-tetraoxa-13,19-dithia-10,22-diazacyclotetracos-10-yl]propoxy]chromen-2-one CAS Name: 4-methyl-7-[3-[22-[3-[(4-methyl-2-oxo-1-benzopyran-7-yl)oxy]propyl]-1,4,7,16-tetraoxa-13,19-dithia-10,22-diazacyclotetracos-10-yl]propoxy]-1-benzopyran-2-one IUPAC Name: 4-methyl-7-[3-[22-[3-(4-methyl-2-oxochromen-7-yl)oxypropyl]-1,4,7,16-tetraoxa-13,19-dithia-10,22-diazacyclotetracos-10-yl]propoxy]chromen-2-one Traditional Name: 7-[3-[22-[3-(2-keto-4-methyl-chromen-7-yl)oxypropyl]-1,4,7,16-tetraoxa-13,19-dithia-10,22-diazacyclotetracos-10-yl]propoxy]-4-methyl-coumarin Formula: C42H58N2O10S2 MolecularWeight: 815.04732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OCCCN3CCOCCOCCOCCN(CCSCCOCCSCC3)CCCOC4=CC5=C(C=C4)C(=CC(=O)O5)C

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OCCCN3CCOCCOCCOCCN(CCSCCOCCSCC3)CCCOC4=CC5=C(C=C4)C(=CC(=O)O5)C

InChI

InChI=1S/C42H58N2O10S2/c1-33-29-41(45)53-39-31-35(5-7-37(33)39)51-15-3-9-43-11-17-47-19-21-49-22-20-48-18-12-44(14-26-56-28-24-50-23-27-55-25-13-43)10-4-16-52-36-6-8-38-34(2)30-42(46)54-40(38)32-36/h5-8,29-32H,3-4,9-28H2,1-2H3