4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[4-methyl-3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]benzamide

Systemtic Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[4-methyl-3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]benzamide Openeye Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[4-methyl-3-(2-oxopyrrolidin-1-yl)phenyl]benzamide CAS Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[4-methyl-3-(2-oxo-1-pyrrolidinyl)phenyl]benzamide IUPAC Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[4-methyl-3-(2-oxopyrrolidin-1-yl)phenyl]benzamide Traditional Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[3-(2-ketopyrrolidino)-4-methyl-phenyl]benzamide Formula: C28H29N3O2 MolecularWeight: 439.54876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3CCC4=CC=CC=C4C3)N5CCCC5=O

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3CCC4=CC=CC=C4C3)N5CCCC5=O

InChI

InChI=1S/C28H29N3O2/c1-20-8-13-25(17-26(20)31-15-4-7-27(31)32)29-28(33)23-11-9-21(10-12-23)18-30-16-14-22-5-2-3-6-24(22)19-30/h2-3,5-6,8-13,17H,4,7,14-16,18-19H2,1H3,(H,29,33)