2-[[bis(azanyl)methylideneamino]methylideneamino]-N-methyl-3-phenyl-propanamide; ethanoic acid

Systemtic Name: 2-[[bis(azanyl)methylideneamino]methylideneamino]-N-methyl-3-phenyl-propanamide; ethanoic acid Openeye Name: acetic acid; 2-(guanidinomethyleneamino)-N-methyl-3-phenyl-propanamide CAS Name: acetic acid; 2-[(diaminomethylideneamino)methylideneamino]-N-methyl-3-phenylpropanamide IUPAC Name: acetic acid; 2-[(diaminomethylideneamino)methylideneamino]-N-methyl-3-phenylpropanamide Traditional Name: acetic acid; 2-(guanidinomethyleneamino)-N-methyl-3-phenyl-propionamide Formula: C14H21N5O3 MolecularWeight: 307.34824

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.CNC(=O)C(CC1=CC=CC=C1)N=CN=C(N)N

Isomeric SMILES

CC(=O)O.CNC(=O)C(CC1=CC=CC=C1)N=CN=C(N)N

InChI

InChI=1S/C12H17N5O.C2H4O2/c1-15-11(18)10(16-8-17-12(13)14)7-9-5-3-2-4-6-9;1-2(3)4/h2-6,8,10H,7H2,1H3,(H,15,18)(H4,13,14,16,17);1H3,(H,3,4)