methyl (2S)-2-[[(2S)-2-[[(2R)-2-azanyl-3-methyl-butanoyl]amino]-3-methyl-butanoyl]amino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[[(2S)-2-[[(2R)-2-azanyl-3-methyl-butanoyl]amino]-3-methyl-butanoyl]amino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[[(2S)-2-[[(2R)-2-amino-3-methyl-butanoyl]amino]-3-methyl-butanoyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[(2S)-2-[[(2R)-2-amino-3-methyl-1-oxobutyl]amino]-3-methyl-1-oxobutyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[(2S)-2-[[(2R)-2-amino-3-methylbutanoyl]amino]-3-methylbutanoyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[(2S)-2-[[(2R)-2-amino-3-methyl-butanoyl]amino]-3-methyl-butanoyl]amino]-3-phenyl-propionic acid methyl ester Formula: C20H31N3O4 MolecularWeight: 377.47784

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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