(4-nitrophenyl)-phenylazanyl-methanesulfonate; phenylazanium

Systemtic Name: (4-nitrophenyl)-phenylazanyl-methanesulfonate; phenylazanium Openeye Name: anilino-(4-nitrophenyl)methanesulfonate; phenylammonium CAS Name: anilino-(4-nitrophenyl)methanesulfonate; phenylammonium IUPAC Name: anilino-(4-nitrophenyl)methanesulfonate; phenylazanium Traditional Name: anilino-(4-nitrophenyl)methanesulfonate; phenylammonium Formula: C19H19N3O5S MolecularWeight: 401.43626

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[NH3+].C1=CC=C(C=C1)NC(C2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)[NH3+].C1=CC=C(C=C1)NC(C2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)[O-]

InChI

InChI=1S/C13H12N2O5S.C6H7N/c16-15(17)12-8-6-10(7-9-12)13(21(18,19)20)14-11-4-2-1-3-5-11;7-6-4-2-1-3-5-6/h1-9,13-14H,(H,18,19,20);1-5H,7H2