2-diazonio-5-phenoxysulfonyl-naphthalen-1-olate; 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene

Systemtic Name: 2-diazonio-5-phenoxysulfonyl-naphthalen-1-olate; 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene Openeye Name: 2-diazonio-5-phenoxysulfonyl-naphthalen-1-olate; 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene CAS Name: 2-diazonio-5-phenoxysulfonyl-1-naphthalenolate; 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene IUPAC Name: 2-diazonio-5-phenoxysulfonylnaphthalen-1-olate; 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene Traditional Name: 2-diazonio-5-phenoxysulfonyl-naphthalen-1-olate; 1-isocyanato-4-(4-isocyanatobenzyl)benzene Formula: C31H20N4O6S MolecularWeight: 576.5787

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC3=C2C=CC(=C3[O-])[N+]#N.C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O

Isomeric SMILES

C1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC3=C2C=CC(=C3[O-])[N+]#N.C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O

InChI

InChI=1S/C16H10N2O4S.C15H10N2O2/c17-18-14-10-9-12-13(16(14)19)7-4-8-15(12)23(20,21)22-11-5-2-1-3-6-11;18-10-16-14-5-1-12(2-6-14)9-13-3-7-15(8-4-13)17-11-19/h1-10H;1-8H,9H2