methyl (3S)-3-[[(2S)-2-benzamido-4-methyl-pentanoyl]amino]butanoate

Systemtic Name: methyl (3S)-3-[[(2S)-2-benzamido-4-methyl-pentanoyl]amino]butanoate Openeye Name: methyl (3S)-3-[[(2S)-2-benzamido-4-methyl-pentanoyl]amino]butanoate CAS Name: (3S)-3-[[(2S)-2-benzamido-4-methyl-1-oxopentyl]amino]butanoic acid methyl ester IUPAC Name: methyl (3S)-3-[[(2S)-2-benzamido-4-methylpentanoyl]amino]butanoate Traditional Name: (3S)-3-[[(2S)-2-benzamido-4-methyl-pentanoyl]amino]butyric acid methyl ester Formula: C18H26N2O4 MolecularWeight: 334.41004

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N2O4/c1-12(2)10-15(18(23)19-13(3)11-16(21)24-4)20-17(22)14-8-6-5-7-9-14/h5-9,12-13,15H,10-11H2,1-4H3,(H,19,23)(H,20,22)/t13-,15-/m0/s1