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

Systemtic Name: (4-chlorophenyl) 3-[4-[bis(azanyl)methylideneamino]phenyl]-2-methyl-propanoate Openeye Name: (4-chlorophenyl) 3-(4-guanidinophenyl)-2-methyl-propanoate CAS Name: 3-[4-(diaminomethylideneamino)phenyl]-2-methylpropanoic acid (4-chlorophenyl) ester IUPAC Name: (4-chlorophenyl) 3-[4-(diaminomethylideneamino)phenyl]-2-methylpropanoate Traditional Name: 3-(4-guanidinophenyl)-2-methyl-propionic acid (4-chlorophenyl) ester Formula: C17H18ClN3O2 MolecularWeight: 331.79672

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18ClN3O2/c1-11(16(22)23-15-8-4-13(18)5-9-15)10-12-2-6-14(7-3-12)21-17(19)20/h2-9,11H,10H2,1H3,(H4,19,20,21)