4-(1-azidononyl)-7-(methoxymethoxy)-3-[4-(methoxymethoxy)phenyl]-3-methyl-2,4-dihydrothiochromene

Systemtic Name: 4-(1-azidononyl)-7-(methoxymethoxy)-3-[4-(methoxymethoxy)phenyl]-3-methyl-2,4-dihydrothiochromene Openeye Name: 4-(1-azidononyl)-7-(methoxymethoxy)-3-[4-(methoxymethoxy)phenyl]-3-methyl-thiochromane CAS Name: 4-(1-azidononyl)-7-(methoxymethoxy)-3-[4-(methoxymethoxy)phenyl]-3-methyl-2,4-dihydro-1-benzothiopyran IUPAC Name: 4-(1-azidononyl)-7-(methoxymethoxy)-3-[4-(methoxymethoxy)phenyl]-3-methyl-2,4-dihydrothiochromene Traditional Name: 4-(1-azidononyl)-7-(methoxymethoxy)-3-[4-(methoxymethoxy)phenyl]-3-methyl-thiochroman Formula: C29H41N3O4S MolecularWeight: 527.71854

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C1C2=C(C=C(C=C2)OCOC)SCC1(C)C3=CC=C(C=C3)OCOC)N=[N+]=[N-]

Isomeric SMILES

CCCCCCCCC(C1C2=C(C=C(C=C2)OCOC)SCC1(C)C3=CC=C(C=C3)OCOC)N=[N+]=[N-]

InChI

InChI=1S/C29H41N3O4S/c1-5-6-7-8-9-10-11-26(31-32-30)28-25-17-16-24(36-21-34-4)18-27(25)37-19-29(28,2)22-12-14-23(15-13-22)35-20-33-3/h12-18,26,28H,5-11,19-21H2,1-4H3