ethyl 4-[[C-(benzotriazol-1-yl)-N-butyl-carbonimidoyl]amino]benzoate

Systemtic Name: ethyl 4-[[C-(benzotriazol-1-yl)-N-butyl-carbonimidoyl]amino]benzoate Openeye Name: ethyl 4-[[C-(benzotriazol-1-yl)-N-butyl-carbonimidoyl]amino]benzoate CAS Name: 4-[[1-benzotriazolyl(butylimino)methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[C-(benzotriazol-1-yl)-N-butylcarbonimidoyl]amino]benzoate Traditional Name: 4-[[C-(benzotriazol-1-yl)-N-butyl-carbonimidoyl]amino]benzoic acid ethyl ester Formula: C20H23N5O2 MolecularWeight: 365.42892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN=C(NC1=CC=C(C=C1)C(=O)OCC)N2C3=CC=CC=C3N=N2

Isomeric SMILES

CCCCN=C(NC1=CC=C(C=C1)C(=O)OCC)N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C20H23N5O2/c1-3-5-14-21-20(25-18-9-7-6-8-17(18)23-24-25)22-16-12-10-15(11-13-16)19(26)27-4-2/h6-13H,3-5,14H2,1-2H3,(H,21,22)