N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-1-ethyl-benzotriazole-5-carboxamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-1-ethyl-benzotriazole-5-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-1-ethyl-benzotriazole-5-carboxamide CAS Name: N-[2-[(1,3-benzodioxol-5-ylamino)-oxomethyl]phenyl]-1-ethyl-5-benzotriazolecarboxamide IUPAC Name: N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-1-ethylbenzotriazole-5-carboxamide Traditional Name: N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-1-ethyl-benzotriazole-5-carboxamide Formula: C23H19N5O4 MolecularWeight: 429.42806

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)NC4=CC5=C(C=C4)OCO5)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)NC4=CC5=C(C=C4)OCO5)N=N1

InChI

InChI=1S/C23H19N5O4/c1-2-28-19-9-7-14(11-18(19)26-27-28)22(29)25-17-6-4-3-5-16(17)23(30)24-15-8-10-20-21(12-15)32-13-31-20/h3-12H,2,13H2,1H3,(H,24,30)(H,25,29)