4-[(4-nitrophenyl)methylazaniumyl]butanoate

Systemtic Name: 4-[(4-nitrophenyl)methylazaniumyl]butanoate Openeye Name: 4-[(4-nitrophenyl)methylammonio]butanoate CAS Name: 4-[(4-nitrophenyl)methylammonio]butanoate IUPAC Name: 4-[(4-nitrophenyl)methylazaniumyl]butanoate Traditional Name: 4-[(4-nitrobenzyl)ammonio]butyrate Formula: C11H14N2O4 MolecularWeight: 238.23986

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C[NH2+]CCCC(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C[NH2+]CCCC(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H14N2O4/c14-11(15)2-1-7-12-8-9-3-5-10(6-4-9)13(16)17/h3-6,12H,1-2,7-8H2,(H,14,15)