2-[3-imidazol-1-ylpropyl-[(2S)-3-methyl-2-(naphthalen-2-ylcarbonylamino)butanoyl]amino]ethanoic acid

Systemtic Name: 2-[3-imidazol-1-ylpropyl-[(2S)-3-methyl-2-(naphthalen-2-ylcarbonylamino)butanoyl]amino]ethanoic acid Openeye Name: 2-[3-imidazol-1-ylpropyl-[(2S)-3-methyl-2-(naphthalene-2-carbonylamino)butanoyl]amino]acetic acid CAS Name: 2-[3-(1-imidazolyl)propyl-[(2S)-3-methyl-2-[[2-naphthalenyl(oxo)methyl]amino]-1-oxobutyl]amino]acetic acid IUPAC Name: 2-[3-imidazol-1-ylpropyl-[(2S)-3-methyl-2-(naphthalene-2-carbonylamino)butanoyl]amino]acetic acid Traditional Name: 2-[3-imidazol-1-ylpropyl-[(2S)-3-methyl-2-(2-naphthoylamino)butanoyl]amino]acetic acid Formula: C24H28N4O4 MolecularWeight: 436.50352

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N(CCCN1C=CN=C1)CC(=O)O)NC(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC(C)[C@@H](C(=O)N(CCCN1C=CN=C1)CC(=O)O)NC(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C24H28N4O4/c1-17(2)22(26-23(31)20-9-8-18-6-3-4-7-19(18)14-20)24(32)28(15-21(29)30)12-5-11-27-13-10-25-16-27/h3-4,6-10,13-14,16-17,22H,5,11-12,15H2,1-2H3,(H,26,31)(H,29,30)/t22-/m0/s1