methyl (2S)-4-methyl-2-[[(2S)-3-phenyl-2-(prop-2-enylamino)propanoyl]amino]pentanoate

Systemtic Name: methyl (2S)-4-methyl-2-[[(2S)-3-phenyl-2-(prop-2-enylamino)propanoyl]amino]pentanoate Openeye Name: methyl (2S)-2-[[(2S)-2-(allylamino)-3-phenyl-propanoyl]amino]-4-methyl-pentanoate CAS Name: (2S)-4-methyl-2-[[(2S)-1-oxo-3-phenyl-2-(prop-2-enylamino)propyl]amino]pentanoic acid methyl ester IUPAC Name: methyl (2S)-4-methyl-2-[[(2S)-3-phenyl-2-(prop-2-enylamino)propanoyl]amino]pentanoate Traditional Name: (2S)-2-[[(2S)-2-(allylamino)-3-phenyl-propanoyl]amino]-4-methyl-valeric acid methyl ester Formula: C19H28N2O3 MolecularWeight: 332.43722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H28N2O3/c1-5-11-20-16(13-15-9-7-6-8-10-15)18(22)21-17(12-14(2)3)19(23)24-4/h5-10,14,16-17,20H,1,11-13H2,2-4H3,(H,21,22)/t16-,17-/m0/s1