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[(4S)-4-benzamido-5-ethoxy-5-oxidanylidene-pentyl]-[bis(azanyl)methylidene]azanium chloride

[(4S)-4-benzamido-5-ethoxy-5-oxidanylidene-pentyl]-[bis(azanyl)methylidene]azanium chloride

Systemtic Name:[(4S)-4-benzamido-5-ethoxy-5-oxidanylidene-pentyl]-[bis(azanyl)methylidene]azanium chloride
Openeye Name:[(4S)-4-benzamido-5-ethoxy-5-oxo-pentyl]-(diaminomethylene)ammonium chloride
CAS Name:[(4S)-4-benzamido-5-ethoxy-5-oxopentyl]-(diaminomethylidene)ammonium chloride
IUPAC Name:[(4S)-4-benzamido-5-ethoxy-5-oxopentyl]-(diaminomethylidene)azanium chloride
Traditional Name:[(4S)-4-benzamido-5-ethoxy-5-keto-pentyl]-(diaminomethylene)ammonium chloride
Formula: C15H23ClN4O3
MolecularWeight: 342.82112
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC[NH+]=C(N)N)NC(=O)C1=CC=CC=C1.[Cl-]


Isomeric SMILES

CCOC(=O)[C@H](CCC[NH+]=C(N)N)NC(=O)C1=CC=CC=C1.[Cl-]


InChI

InChI=1S/C15H22N4O3.ClH/c1-2-22-14(21)12(9-6-10-18-15(16)17)19-13(20)11-7-4-3-5-8-11;/h3-5,7-8,12H,2,6,9-10H2,1H3,(H,19,20)(H4,16,17,18);1H/t12-;/m0./s1


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