methyl (2S)-2-[(3S,7S)-3-azanyl-2-oxidanylidene-7-propyl-azepan-1-yl]propanoate

Systemtic Name: methyl (2S)-2-[(3S,7S)-3-azanyl-2-oxidanylidene-7-propyl-azepan-1-yl]propanoate Openeye Name: methyl (2S)-2-[(3S,7S)-3-amino-2-oxo-7-propyl-azepan-1-yl]propanoate CAS Name: (2S)-2-[(3S,7S)-3-amino-2-oxo-7-propyl-1-azepanyl]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(3S,7S)-3-amino-2-oxo-7-propylazepan-1-yl]propanoate Traditional Name: (2S)-2-[(3S,7S)-3-amino-2-keto-7-propyl-azepan-1-yl]propionic acid methyl ester Formula: C13H24N2O3 MolecularWeight: 256.34126

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCCC(C(=O)N1C(C)C(=O)OC)N

Isomeric SMILES

CCC[C@H]1CCC[C@@H](C(=O)N1[C@@H](C)C(=O)OC)N

InChI

InChI=1S/C13H24N2O3/c1-4-6-10-7-5-8-11(14)12(16)15(10)9(2)13(17)18-3/h9-11H,4-8,14H2,1-3H3/t9-,10-,11-/m0/s1