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

Systemtic Name: methyl (2S)-2-[[(2S)-2-azanyl-4-methyl-pentanoyl]-methyl-amino]-3-(4-phenylmethoxyphenyl)propanoate Openeye Name: methyl (2S)-2-[[(2S)-2-amino-4-methyl-pentanoyl]-methyl-amino]-3-(4-benzyloxyphenyl)propanoate CAS Name: (2S)-2-[[(2S)-2-amino-4-methyl-1-oxopentyl]-methylamino]-3-(4-phenylmethoxyphenyl)propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[(2S)-2-amino-4-methylpentanoyl]-methylamino]-3-(4-phenylmethoxyphenyl)propanoate Traditional Name: (2S)-2-[[(2S)-2-amino-4-methyl-pentanoyl]-methyl-amino]-3-(4-benzoxyphenyl)propionic acid methyl ester Formula: C24H32N2O4 MolecularWeight: 412.52188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N(C)C(CC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)OC)N

Isomeric SMILES

CC(C)C[C@@H](C(=O)N(C)[C@@H](CC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)OC)N

InChI

InChI=1S/C24H32N2O4/c1-17(2)14-21(25)23(27)26(3)22(24(28)29-4)15-18-10-12-20(13-11-18)30-16-19-8-6-5-7-9-19/h5-13,17,21-22H,14-16,25H2,1-4H3/t21-,22-/m0/s1