(2R)-2-[[(2S)-3-azanyl-1-[[(2S)-4-methyl-1-oxidanylidene-1-phenylazanyl-pentan-2-yl]amino]-1-oxidanylidene-propan-2-yl]amino]propanoic acid

Systemtic Name: (2R)-2-[[(2S)-3-azanyl-1-[[(2S)-4-methyl-1-oxidanylidene-1-phenylazanyl-pentan-2-yl]amino]-1-oxidanylidene-propan-2-yl]amino]propanoic acid Openeye Name: (2R)-2-[[(1S)-1-(aminomethyl)-2-[[(1S)-3-methyl-1-(phenylcarbamoyl)butyl]amino]-2-oxo-ethyl]amino]propanoic acid CAS Name: (2R)-2-[[(2S)-3-amino-1-[[(2S)-1-anilino-4-methyl-1-oxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]propanoic acid IUPAC Name: (2R)-2-[[(2S)-3-amino-1-[[(2S)-1-anilino-4-methyl-1-oxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]propanoic acid Traditional Name: (2R)-2-[[(1S)-1-(aminomethyl)-2-keto-2-[[(1S)-3-methyl-1-(phenylcarbamoyl)butyl]amino]ethyl]amino]propionic acid Formula: C18H28N4O4 MolecularWeight: 364.43932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1=CC=CC=C1)NC(=O)C(CN)NC(C)C(=O)O

Isomeric SMILES

C[C@H](C(=O)O)N[C@@H](CN)C(=O)N[C@@H](CC(C)C)C(=O)NC1=CC=CC=C1

InChI

InChI=1S/C18H28N4O4/c1-11(2)9-14(16(23)21-13-7-5-4-6-8-13)22-17(24)15(10-19)20-12(3)18(25)26/h4-8,11-12,14-15,20H,9-10,19H2,1-3H3,(H,21,23)(H,22,24)(H,25,26)/t12-,14+,15+/m1/s1