2-chloranyl-4-[ethyl-(3-phenyl-1-sulfanyl-propyl)amino]-5-methoxy-benzenediazonium

Systemtic Name: 2-chloranyl-4-[ethyl-(3-phenyl-1-sulfanyl-propyl)amino]-5-methoxy-benzenediazonium Openeye Name: 2-chloro-4-[ethyl-(3-phenyl-1-sulfanyl-propyl)amino]-5-methoxy-benzenediazonium CAS Name: 2-chloro-4-[ethyl-(1-mercapto-3-phenylpropyl)amino]-5-methoxybenzenediazonium IUPAC Name: 2-chloro-4-[ethyl-(3-phenyl-1-sulfanylpropyl)amino]-5-methoxybenzenediazonium Traditional Name: 2-chloro-4-[ethyl-(1-mercapto-3-phenyl-propyl)amino]-5-methoxy-benzenediazonium Formula: C18H21ClN3OS+ MolecularWeight: 362.89684

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=C(C=C(C(=C1)Cl)[N+]#N)OC)C(CCC2=CC=CC=C2)S

Isomeric SMILES

CCN(C1=C(C=C(C(=C1)Cl)[N+]#N)OC)C(CCC2=CC=CC=C2)S

InChI

InChI=1S/C18H20ClN3OS/c1-3-22(18(24)10-9-13-7-5-4-6-8-13)16-11-14(19)15(21-20)12-17(16)23-2/h4-8,11-12,18H,3,9-10H2,1-2H3/p+1