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

Systemtic Name: N-[4-(azepan-1-ylcarbonyl)phenyl]-1-butyl-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-[4-(azepane-1-carbonyl)phenyl]-1-butyl-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-[4-[1-azepanyl(oxo)methyl]phenyl]-1-butyl-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-[4-(azepane-1-carbonyl)phenyl]-1-butyl-5-oxopyrrolidine-3-carboxamide Traditional Name: N-[4-(azepane-1-carbonyl)phenyl]-1-butyl-5-keto-pyrrolidine-3-carboxamide Formula: C22H31N3O3 MolecularWeight: 385.49984

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CC(CC1=O)C(=O)NC2=CC=C(C=C2)C(=O)N3CCCCCC3

Isomeric SMILES

CCCCN1CC(CC1=O)C(=O)NC2=CC=C(C=C2)C(=O)N3CCCCCC3

InChI

InChI=1S/C22H31N3O3/c1-2-3-12-25-16-18(15-20(25)26)21(27)23-19-10-8-17(9-11-19)22(28)24-13-6-4-5-7-14-24/h8-11,18H,2-7,12-16H2,1H3,(H,23,27)