N-[4-(benzotriazol-1-ylcarbonyl)phenyl]-1-butyl-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-[4-(benzotriazol-1-ylcarbonyl)phenyl]-1-butyl-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-[4-(benzotriazole-1-carbonyl)phenyl]-1-butyl-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-[4-[1-benzotriazolyl(oxo)methyl]phenyl]-1-butyl-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-[4-(benzotriazole-1-carbonyl)phenyl]-1-butyl-5-oxopyrrolidine-3-carboxamide Traditional Name: N-[4-(benzotriazole-1-carbonyl)phenyl]-1-butyl-5-keto-pyrrolidine-3-carboxamide Formula: C22H23N5O3 MolecularWeight: 405.44972

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CC(CC1=O)C(=O)NC2=CC=C(C=C2)C(=O)N3C4=CC=CC=C4N=N3

Isomeric SMILES

CCCCN1CC(CC1=O)C(=O)NC2=CC=C(C=C2)C(=O)N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C22H23N5O3/c1-2-3-12-26-14-16(13-20(26)28)21(29)23-17-10-8-15(9-11-17)22(30)27-19-7-5-4-6-18(19)24-25-27/h4-11,16H,2-3,12-14H2,1H3,(H,23,29)