phenyl 3-[4-[bis(azanyl)methylideneamino]phenyl]-2-methyl-propanoate

Systemtic Name: phenyl 3-[4-[bis(azanyl)methylideneamino]phenyl]-2-methyl-propanoate Openeye Name: phenyl 3-(4-guanidinophenyl)-2-methyl-propanoate CAS Name: 3-[4-(diaminomethylideneamino)phenyl]-2-methylpropanoic acid phenyl ester IUPAC Name: phenyl 3-[4-(diaminomethylideneamino)phenyl]-2-methylpropanoate Traditional Name: 3-(4-guanidinophenyl)-2-methyl-propionic acid phenyl ester Formula: C17H19N3O2 MolecularWeight: 297.35166

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(C=C1)N=C(N)N)C(=O)OC2=CC=CC=C2

Isomeric SMILES

CC(CC1=CC=C(C=C1)N=C(N)N)C(=O)OC2=CC=CC=C2

InChI

InChI=1S/C17H19N3O2/c1-12(16(21)22-15-5-3-2-4-6-15)11-13-7-9-14(10-8-13)20-17(18)19/h2-10,12H,11H2,1H3,(H4,18,19,20)