heptyl (2S)-3-methyl-2-(2-methylpropoxycarbonylamino)pentanoate

Systemtic Name: heptyl (2S)-3-methyl-2-(2-methylpropoxycarbonylamino)pentanoate Openeye Name: heptyl (2S)-2-(isobutoxycarbonylamino)-3-methyl-pentanoate CAS Name: (2S)-3-methyl-2-[[2-methylpropoxy(oxo)methyl]amino]pentanoic acid heptyl ester IUPAC Name: heptyl (2S)-3-methyl-2-(2-methylpropoxycarbonylamino)pentanoate Traditional Name: (2S)-2-(isobutoxycarbonylamino)-3-methyl-valeric acid heptyl ester Formula: C18H35NO4 MolecularWeight: 329.4748

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C(C(C)CC)NC(=O)OCC(C)C

Isomeric SMILES

CCCCCCCOC(=O)[C@H](C(C)CC)NC(=O)OCC(C)C

InChI

InChI=1S/C18H35NO4/c1-6-8-9-10-11-12-22-17(20)16(15(5)7-2)19-18(21)23-13-14(3)4/h14-16H,6-13H2,1-5H3,(H,19,21)/t15?,16-/m0/s1