N-[[4-(aminomethyl)phenyl]methyl]-3-(3-cyclopentylpropanoylamino)-4-(pyrrolidin-1-ylmethyl)benzamide

Systemtic Name: N-[[4-(aminomethyl)phenyl]methyl]-3-(3-cyclopentylpropanoylamino)-4-(pyrrolidin-1-ylmethyl)benzamide Openeye Name: N-[[4-(aminomethyl)phenyl]methyl]-3-(3-cyclopentylpropanoylamino)-4-(pyrrolidin-1-ylmethyl)benzamide CAS Name: N-[[4-(aminomethyl)phenyl]methyl]-3-[(3-cyclopentyl-1-oxopropyl)amino]-4-(1-pyrrolidinylmethyl)benzamide IUPAC Name: N-[[4-(aminomethyl)phenyl]methyl]-3-(3-cyclopentylpropanoylamino)-4-(pyrrolidin-1-ylmethyl)benzamide Traditional Name: N-[4-(aminomethyl)benzyl]-3-(3-cyclopentylpropanoylamino)-4-(pyrrolidinomethyl)benzamide Formula: C28H38N4O2 MolecularWeight: 462.62692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCC(=O)NC2=C(C=CC(=C2)C(=O)NCC3=CC=C(C=C3)CN)CN4CCCC4

Isomeric SMILES

C1CCC(C1)CCC(=O)NC2=C(C=CC(=C2)C(=O)NCC3=CC=C(C=C3)CN)CN4CCCC4

InChI

InChI=1S/C28H38N4O2/c29-18-22-7-9-23(10-8-22)19-30-28(34)24-12-13-25(20-32-15-3-4-16-32)26(17-24)31-27(33)14-11-21-5-1-2-6-21/h7-10,12-13,17,21H,1-6,11,14-16,18-20,29H2,(H,30,34)(H,31,33)