(S)-(4-nitrophenyl)-phenylazanyl-methanesulfonic acid

Systemtic Name: (S)-(4-nitrophenyl)-phenylazanyl-methanesulfonic acid Openeye Name: (S)-anilino-(4-nitrophenyl)methanesulfonic acid CAS Name: (S)-anilino-(4-nitrophenyl)methanesulfonic acid IUPAC Name: (S)-anilino-(4-nitrophenyl)methanesulfonic acid Traditional Name: (S)-anilino-(4-nitrophenyl)methanesulfonic acid Formula: C13H12N2O5S MolecularWeight: 308.30978

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Descriptors Computed from Structure

Canonical SMILES:

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)N[C@H](C2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)O

InChI

InChI=1S/C13H12N2O5S/c16-15(17)12-8-6-10(7-9-12)13(21(18,19)20)14-11-4-2-1-3-5-11/h1-9,13-14H,(H,18,19,20)/t13-/m0/s1