3-azanyl-3-[1-(4-nitrophenyl)pyrrol-2-yl]propanoic acid

Systemtic Name: 3-azanyl-3-[1-(4-nitrophenyl)pyrrol-2-yl]propanoic acid Openeye Name: 3-amino-3-[1-(4-nitrophenyl)pyrrol-2-yl]propanoic acid CAS Name: 3-amino-3-[1-(4-nitrophenyl)-2-pyrrolyl]propanoic acid IUPAC Name: 3-amino-3-[1-(4-nitrophenyl)pyrrol-2-yl]propanoic acid Traditional Name: 3-amino-3-[1-(4-nitrophenyl)pyrrol-2-yl]propionic acid Formula: C13H13N3O4 MolecularWeight: 275.26002

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=C1)C(CC(=O)O)N)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CN(C(=C1)C(CC(=O)O)N)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H13N3O4/c14-11(8-13(17)18)12-2-1-7-15(12)9-3-5-10(6-4-9)16(19)20/h1-7,11H,8,14H2,(H,17,18)