(4-tert-butylphenyl) 4-[bis(azanyl)methylideneamino]benzoate

Systemtic Name: (4-tert-butylphenyl) 4-[bis(azanyl)methylideneamino]benzoate Openeye Name: (4-tert-butylphenyl) 4-guanidinobenzoate CAS Name: 4-(diaminomethylideneamino)benzoic acid (4-tert-butylphenyl) ester IUPAC Name: (4-tert-butylphenyl) 4-(diaminomethylideneamino)benzoate Traditional Name: 4-guanidinobenzoic acid (4-tert-butylphenyl) ester Formula: C18H21N3O2 MolecularWeight: 311.37824

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)N=C(N)N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)N=C(N)N

InChI

InChI=1S/C18H21N3O2/c1-18(2,3)13-6-10-15(11-7-13)23-16(22)12-4-8-14(9-5-12)21-17(19)20/h4-11H,1-3H3,(H4,19,20,21)