4-(azepan-1-ylmethyl)-N-[4-methyl-3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]benzamide

Systemtic Name: 4-(azepan-1-ylmethyl)-N-[4-methyl-3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]benzamide Openeye Name: 4-(azepan-1-ylmethyl)-N-[4-methyl-3-(2-oxopyrrolidin-1-yl)phenyl]benzamide CAS Name: 4-(1-azepanylmethyl)-N-[4-methyl-3-(2-oxo-1-pyrrolidinyl)phenyl]benzamide IUPAC Name: 4-(azepan-1-ylmethyl)-N-[4-methyl-3-(2-oxopyrrolidin-1-yl)phenyl]benzamide Traditional Name: 4-(azepan-1-ylmethyl)-N-[3-(2-ketopyrrolidino)-4-methyl-phenyl]benzamide Formula: C25H31N3O2 MolecularWeight: 405.53254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3CCCCCC3)N4CCCC4=O

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3CCCCCC3)N4CCCC4=O

InChI

InChI=1S/C25H31N3O2/c1-19-8-13-22(17-23(19)28-16-6-7-24(28)29)26-25(30)21-11-9-20(10-12-21)18-27-14-4-2-3-5-15-27/h8-13,17H,2-7,14-16,18H2,1H3,(H,26,30)