methyl (2S)-2-[[2-[[(2S)-2-azanyl-4-methyl-pentanoyl]amino]-2-methyl-propanoyl]amino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[[2-[[(2S)-2-azanyl-4-methyl-pentanoyl]amino]-2-methyl-propanoyl]amino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[[2-[[(2S)-2-amino-4-methyl-pentanoyl]amino]-2-methyl-propanoyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[2-[[(2S)-2-amino-4-methyl-1-oxopentyl]amino]-2-methyl-1-oxopropyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[2-[[(2S)-2-amino-4-methylpentanoyl]amino]-2-methylpropanoyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[2-[[(2S)-2-amino-4-methyl-pentanoyl]amino]-2-methyl-propanoyl]amino]-3-phenyl-propionic acid methyl ester Formula: C20H31N3O4 MolecularWeight: 377.47784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(C)(C)C(=O)NC(CC1=CC=CC=C1)C(=O)OC)N

Isomeric SMILES

CC(C)C[C@@H](C(=O)NC(C)(C)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)OC)N

InChI

InChI=1S/C20H31N3O4/c1-13(2)11-15(21)17(24)23-20(3,4)19(26)22-16(18(25)27-5)12-14-9-7-6-8-10-14/h6-10,13,15-16H,11-12,21H2,1-5H3,(H,22,26)(H,23,24)/t15-,16-/m0/s1