2-methoxy-4-oxidanyl-5-(phenylcarbonyl)benzenesulfonate; 2,4,6-tributoxybenzenediazonium

Systemtic Name: 2-methoxy-4-oxidanyl-5-(phenylcarbonyl)benzenesulfonate; 2,4,6-tributoxybenzenediazonium Openeye Name: 5-benzoyl-4-hydroxy-2-methoxy-benzenesulfonate; 2,4,6-tributoxybenzenediazonium CAS Name: 5-benzoyl-4-hydroxy-2-methoxybenzenesulfonate; 2,4,6-tributoxybenzenediazonium IUPAC Name: 5-benzoyl-4-hydroxy-2-methoxybenzenesulfonate; 2,4,6-tributoxybenzenediazonium Traditional Name: 5-benzoyl-4-hydroxy-2-methoxy-besylate; 2,4,6-tributoxybenzenediazonium Formula: C32H40N2O9S MolecularWeight: 628.733

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC(=C(C(=C1)OCCCC)[N+]#N)OCCCC.COC1=C(C=C(C(=C1)O)C(=O)C2=CC=CC=C2)S(=O)(=O)[O-]

Isomeric SMILES

CCCCOC1=CC(=C(C(=C1)OCCCC)[N+]#N)OCCCC.COC1=C(C=C(C(=C1)O)C(=O)C2=CC=CC=C2)S(=O)(=O)[O-]

InChI

InChI=1S/C18H29N2O3.C14H12O6S/c1-4-7-10-21-15-13-16(22-11-8-5-2)18(20-19)17(14-15)23-12-9-6-3;1-20-12-8-11(15)10(7-13(12)21(17,18)19)14(16)9-5-3-2-4-6-9/h13-14H,4-12H2,1-3H3;2-8,15H,1H3,(H,17,18,19)/q+1;/p-1