methyl 2-[(2-azido-3-chloranyl-3-oxidanylidene-propyl)amino]-2-phenyl-ethanoate hydrochloride

Systemtic Name: methyl 2-[(2-azido-3-chloranyl-3-oxidanylidene-propyl)amino]-2-phenyl-ethanoate hydrochloride Openeye Name: methyl 2-[(2-azido-3-chloro-3-oxo-propyl)amino]-2-phenyl-acetate hydrochloride CAS Name: 2-[(2-azido-3-chloro-3-oxopropyl)amino]-2-phenylacetic acid methyl ester hydrochloride IUPAC Name: methyl 2-[(2-azido-3-chloro-3-oxopropyl)amino]-2-phenylacetate hydrochloride Traditional Name: 2-[(2-azido-3-chloro-3-keto-propyl)amino]-2-phenyl-acetic acid methyl ester hydrochloride Formula: C12H14Cl2N4O3 MolecularWeight: 333.17056

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1)NCC(C(=O)Cl)N=[N+]=[N-].Cl

Isomeric SMILES

COC(=O)C(C1=CC=CC=C1)NCC(C(=O)Cl)N=[N+]=[N-].Cl

InChI

InChI=1S/C12H13ClN4O3.ClH/c1-20-12(19)10(8-5-3-2-4-6-8)15-7-9(11(13)18)16-17-14;/h2-6,9-10,15H,7H2,1H3;1H