ethyl (4S)-4-[[(2S)-2-azanyl-3-methyl-pentanoyl]amino]-6-methyl-3-oxidanyl-heptanoate

Systemtic Name: ethyl (4S)-4-[[(2S)-2-azanyl-3-methyl-pentanoyl]amino]-6-methyl-3-oxidanyl-heptanoate Openeye Name: ethyl (4S)-4-[[(2S)-2-amino-3-methyl-pentanoyl]amino]-3-hydroxy-6-methyl-heptanoate CAS Name: (4S)-4-[[(2S)-2-amino-3-methyl-1-oxopentyl]amino]-3-hydroxy-6-methylheptanoic acid ethyl ester IUPAC Name: ethyl (4S)-4-[[(2S)-2-amino-3-methylpentanoyl]amino]-3-hydroxy-6-methylheptanoate Traditional Name: (4S)-4-[[(2S)-2-amino-3-methyl-pentanoyl]amino]-3-hydroxy-6-methyl-enanthic acid ethyl ester Formula: C16H32N2O4 MolecularWeight: 316.43628

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(CC(C)C)C(CC(=O)OCC)O)N

Isomeric SMILES

CCC(C)[C@@H](C(=O)N[C@@H](CC(C)C)C(CC(=O)OCC)O)N

InChI

InChI=1S/C16H32N2O4/c1-6-11(5)15(17)16(21)18-12(8-10(3)4)13(19)9-14(20)22-7-2/h10-13,15,19H,6-9,17H2,1-5H3,(H,18,21)/t11?,12-,13?,15-/m0/s1