2-cyanoethyl 3-azanyl-3-phenylimino-propanoate

Systemtic Name: 2-cyanoethyl 3-azanyl-3-phenylimino-propanoate Openeye Name: 2-cyanoethyl 3-amino-3-phenylimino-propanoate CAS Name: 3-amino-3-phenyliminopropanoic acid 2-cyanoethyl ester IUPAC Name: 2-cyanoethyl 3-amino-3-phenyliminopropanoate Traditional Name: 3-amino-3-phenylimino-propionic acid 2-cyanoethyl ester Formula: C12H13N3O2 MolecularWeight: 231.25052

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N=C(CC(=O)OCCC#N)N

Isomeric SMILES

C1=CC=C(C=C1)N=C(CC(=O)OCCC#N)N

InChI

InChI=1S/C12H13N3O2/c13-7-4-8-17-12(16)9-11(14)15-10-5-2-1-3-6-10/h1-3,5-6H,4,8-9H2,(H2,14,15)