6-[diazo-(6,7-dihexoxynaphthalen-2-yl)sulfonyl-methyl]sulfonyl-2,3-dihexoxy-naphthalene

Systemtic Name: 6-[diazo-(6,7-dihexoxynaphthalen-2-yl)sulfonyl-methyl]sulfonyl-2,3-dihexoxy-naphthalene Openeye Name: 6-[diazo-[(6,7-dihexoxy-2-naphthyl)sulfonyl]methyl]sulfonyl-2,3-dihexoxy-naphthalene CAS Name: 6-[diazo-[(6,7-dihexoxy-2-naphthalenyl)sulfonyl]methyl]sulfonyl-2,3-dihexoxynaphthalene IUPAC Name: 6-[diazo-(6,7-dihexoxynaphthalen-2-yl)sulfonylmethyl]sulfonyl-2,3-dihexoxynaphthalene Traditional Name: 6-[diazo-[(6,7-dihexoxy-2-naphthyl)sulfonyl]methyl]sulfonyl-2,3-dihexoxy-naphthalene Formula: C45H62N2O8S2 MolecularWeight: 823.11238

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C2C=C(C=CC2=C1)S(=O)(=O)C(=[N+]=[N-])S(=O)(=O)C3=CC4=CC(=C(C=C4C=C3)OCCCCCC)OCCCCCC)OCCCCCC

Isomeric SMILES

CCCCCCOC1=C(C=C2C=C(C=CC2=C1)S(=O)(=O)C(=[N+]=[N-])S(=O)(=O)C3=CC4=CC(=C(C=C4C=C3)OCCCCCC)OCCCCCC)OCCCCCC

InChI

InChI=1S/C45H62N2O8S2/c1-5-9-13-17-25-52-41-31-35-21-23-39(29-37(35)33-43(41)54-27-19-15-11-7-3)56(48,49)45(47-46)57(50,51)40-24-22-36-32-42(53-26-18-14-10-6-2)44(34-38(36)30-40)55-28-20-16-12-8-4/h21-24,29-34H,5-20,25-28H2,1-4H3