[4-[bis(azanyl)methylideneamino]phenyl] (2R)-2-benzamidopropanoate

Systemtic Name: [4-[bis(azanyl)methylideneamino]phenyl] (2R)-2-benzamidopropanoate Openeye Name: (4-guanidinophenyl) (2R)-2-benzamidopropanoate CAS Name: (2R)-2-benzamidopropanoic acid [4-(diaminomethylideneamino)phenyl] ester IUPAC Name: [4-(diaminomethylideneamino)phenyl] (2R)-2-benzamidopropanoate Traditional Name: (2R)-2-benzamidopropionic acid (4-guanidinophenyl) ester Formula: C17H18N4O3 MolecularWeight: 326.34982

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC1=CC=C(C=C1)N=C(N)N)NC(=O)C2=CC=CC=C2

Isomeric SMILES

C[C@H](C(=O)OC1=CC=C(C=C1)N=C(N)N)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H18N4O3/c1-11(20-15(22)12-5-3-2-4-6-12)16(23)24-14-9-7-13(8-10-14)21-17(18)19/h2-11H,1H3,(H,20,22)(H4,18,19,21)/t11-/m1/s1