(4-phenyldiazenylphenyl) N-[[4-[bis(azanyl)methylideneamino]phenyl]methyl]carbamate

Systemtic Name: (4-phenyldiazenylphenyl) N-[[4-[bis(azanyl)methylideneamino]phenyl]methyl]carbamate Openeye Name: (4-phenylazophenyl) N-[(4-guanidinophenyl)methyl]carbamate CAS Name: N-[[4-(diaminomethylideneamino)phenyl]methyl]carbamic acid (4-phenyldiazenylphenyl) ester IUPAC Name: (4-phenyldiazenylphenyl) N-[[4-(diaminomethylideneamino)phenyl]methyl]carbamate Traditional Name: N-(4-guanidinobenzyl)carbamic acid (4-phenylazophenyl) ester Formula: C21H20N6O2 MolecularWeight: 388.4225

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N=NC2=CC=C(C=C2)OC(=O)NCC3=CC=C(C=C3)N=C(N)N

Isomeric SMILES

C1=CC=C(C=C1)N=NC2=CC=C(C=C2)OC(=O)NCC3=CC=C(C=C3)N=C(N)N

InChI

InChI=1S/C21H20N6O2/c22-20(23)25-16-8-6-15(7-9-16)14-24-21(28)29-19-12-10-18(11-13-19)27-26-17-4-2-1-3-5-17/h1-13H,14H2,(H,24,28)(H4,22,23,25)