(2-bromophenyl) 2-[[4-[bis(azanyl)methylideneamino]phenyl]methyl]butanoate

Systemtic Name: (2-bromophenyl) 2-[[4-[bis(azanyl)methylideneamino]phenyl]methyl]butanoate Openeye Name: (2-bromophenyl) 2-[(4-guanidinophenyl)methyl]butanoate CAS Name: 2-[[4-(diaminomethylideneamino)phenyl]methyl]butanoic acid (2-bromophenyl) ester IUPAC Name: (2-bromophenyl) 2-[[4-(diaminomethylideneamino)phenyl]methyl]butanoate Traditional Name: 2-(4-guanidinobenzyl)butyric acid (2-bromophenyl) ester Formula: C18H20BrN3O2 MolecularWeight: 390.2743

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC=C(C=C1)N=C(N)N)C(=O)OC2=CC=CC=C2Br

Isomeric SMILES

CCC(CC1=CC=C(C=C1)N=C(N)N)C(=O)OC2=CC=CC=C2Br

InChI

InChI=1S/C18H20BrN3O2/c1-2-13(17(23)24-16-6-4-3-5-15(16)19)11-12-7-9-14(10-8-12)22-18(20)21/h3-10,13H,2,11H2,1H3,(H4,20,21,22)