methyl (2S)-2-[[(2R)-2-azanyl-4-methyl-pentanoyl]-phenylmethoxycarbonyl-amino]-4-methyl-pentanoate

Systemtic Name: methyl (2S)-2-[[(2R)-2-azanyl-4-methyl-pentanoyl]-phenylmethoxycarbonyl-amino]-4-methyl-pentanoate Openeye Name: methyl (2S)-2-[[(2R)-2-amino-4-methyl-pentanoyl]-benzyloxycarbonyl-amino]-4-methyl-pentanoate CAS Name: (2S)-2-[[(2R)-2-amino-4-methyl-1-oxopentyl]-phenylmethoxycarbonylamino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[(2R)-2-amino-4-methylpentanoyl]-phenylmethoxycarbonylamino]-4-methylpentanoate Traditional Name: (2S)-2-[[(2R)-2-amino-4-methyl-pentanoyl]-carbobenzoxy-amino]-4-methyl-valeric acid methyl ester Formula: C21H32N2O5 MolecularWeight: 392.48918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N(C(CC(C)C)C(=O)OC)C(=O)OCC1=CC=CC=C1)N

Isomeric SMILES

CC(C)C[C@H](C(=O)N([C@@H](CC(C)C)C(=O)OC)C(=O)OCC1=CC=CC=C1)N

InChI

InChI=1S/C21H32N2O5/c1-14(2)11-17(22)19(24)23(18(12-15(3)4)20(25)27-5)21(26)28-13-16-9-7-6-8-10-16/h6-10,14-15,17-18H,11-13,22H2,1-5H3/t17-,18+/m1/s1