2-[[2-azanyl-3-(4-bromophenyl)propanoyl]-naphthalen-1-yl-amino]propanoic acid

Systemtic Name: 2-[[2-azanyl-3-(4-bromophenyl)propanoyl]-naphthalen-1-yl-amino]propanoic acid Openeye Name: 2-[[2-amino-3-(4-bromophenyl)propanoyl]-(1-naphthyl)amino]propanoic acid CAS Name: 2-[[2-amino-3-(4-bromophenyl)-1-oxopropyl]-(1-naphthalenyl)amino]propanoic acid IUPAC Name: 2-[[2-amino-3-(4-bromophenyl)propanoyl]-naphthalen-1-ylamino]propanoic acid Traditional Name: 2-[[2-amino-3-(4-bromophenyl)propanoyl]-(1-naphthyl)amino]propionic acid Formula: C22H21BrN2O3 MolecularWeight: 441.31774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N(C1=CC=CC2=CC=CC=C21)C(=O)C(CC3=CC=C(C=C3)Br)N

Isomeric SMILES

CC(C(=O)O)N(C1=CC=CC2=CC=CC=C21)C(=O)C(CC3=CC=C(C=C3)Br)N

InChI

InChI=1S/C22H21BrN2O3/c1-14(22(27)28)25(20-8-4-6-16-5-2-3-7-18(16)20)21(26)19(24)13-15-9-11-17(23)12-10-15/h2-12,14,19H,13,24H2,1H3,(H,27,28)