N-[1-(5-azanylpentylamino)-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]-1-(2-ethylbutanoyl)pyrrolidine-2-carboxamide

Systemtic Name: N-[1-(5-azanylpentylamino)-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]-1-(2-ethylbutanoyl)pyrrolidine-2-carboxamide Openeye Name: N-[2-(5-aminopentylamino)-1-(2-naphthylmethyl)-2-oxo-ethyl]-1-(2-ethylbutanoyl)pyrrolidine-2-carboxamide CAS Name: N-[1-(5-aminopentylamino)-3-(2-naphthalenyl)-1-oxopropan-2-yl]-1-(2-ethyl-1-oxobutyl)-2-pyrrolidinecarboxamide IUPAC Name: N-[1-(5-aminopentylamino)-3-naphthalen-2-yl-1-oxopropan-2-yl]-1-(2-ethylbutanoyl)pyrrolidine-2-carboxamide Traditional Name: N-[2-(5-aminopentylamino)-2-keto-1-(2-naphthylmethyl)ethyl]-1-(2-ethylbutanoyl)pyrrolidine-2-carboxamide Formula: C29H42N4O3 MolecularWeight: 494.66878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)N1CCCC1C(=O)NC(CC2=CC3=CC=CC=C3C=C2)C(=O)NCCCCCN

Isomeric SMILES

CCC(CC)C(=O)N1CCCC1C(=O)NC(CC2=CC3=CC=CC=C3C=C2)C(=O)NCCCCCN

InChI

InChI=1S/C29H42N4O3/c1-3-22(4-2)29(36)33-18-10-13-26(33)28(35)32-25(27(34)31-17-9-5-8-16-30)20-21-14-15-23-11-6-7-12-24(23)19-21/h6-7,11-12,14-15,19,22,25-26H,3-5,8-10,13,16-18,20,30H2,1-2H3,(H,31,34)(H,32,35)