2-(aminomethyl)-2-azanyl-3-[(4-bromophenyl)methoxy]-3-oxidanylidene-propanoic acid

Systemtic Name: 2-(aminomethyl)-2-azanyl-3-[(4-bromophenyl)methoxy]-3-oxidanylidene-propanoic acid Openeye Name: 2-amino-2-(aminomethyl)-3-[(4-bromophenyl)methoxy]-3-oxo-propanoic acid CAS Name: 2-amino-2-(aminomethyl)-3-[(4-bromophenyl)methoxy]-3-oxopropanoic acid IUPAC Name: 2-amino-2-(aminomethyl)-3-[(4-bromophenyl)methoxy]-3-oxopropanoic acid Traditional Name: 2-amino-2-(aminomethyl)-3-(4-bromobenzyl)oxy-3-keto-propionic acid Formula: C11H13BrN2O4 MolecularWeight: 317.13592

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC(=O)C(CN)(C(=O)O)N)Br

Isomeric SMILES

C1=CC(=CC=C1COC(=O)C(CN)(C(=O)O)N)Br

InChI

InChI=1S/C11H13BrN2O4/c12-8-3-1-7(2-4-8)5-18-10(17)11(14,6-13)9(15)16/h1-4H,5-6,13-14H2,(H,15,16)