2-[naphthalen-1-ylcarbamoyl-[(2-nitrophenyl)methyl]amino]propanoic acid

Systemtic Name: 2-[naphthalen-1-ylcarbamoyl-[(2-nitrophenyl)methyl]amino]propanoic acid Openeye Name: 2-[1-naphthylcarbamoyl-[(2-nitrophenyl)methyl]amino]propanoic acid CAS Name: 2-[[(1-naphthalenylamino)-oxomethyl]-[(2-nitrophenyl)methyl]amino]propanoic acid IUPAC Name: 2-[naphthalen-1-ylcarbamoyl-[(2-nitrophenyl)methyl]amino]propanoic acid Traditional Name: 2-[1-naphthylcarbamoyl-(2-nitrobenzyl)amino]propionic acid Formula: C21H19N3O5 MolecularWeight: 393.39266

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N(CC1=CC=CC=C1[N+](=O)[O-])C(=O)NC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC(C(=O)O)N(CC1=CC=CC=C1[N+](=O)[O-])C(=O)NC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C21H19N3O5/c1-14(20(25)26)23(13-16-8-3-5-12-19(16)24(28)29)21(27)22-18-11-6-9-15-7-2-4-10-17(15)18/h2-12,14H,13H2,1H3,(H,22,27)(H,25,26)