N1-[5-cyano-1-(4-hydroxyphenyl)-3,4-bis(oxidanyl)pentan-2-yl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide

Systemtic Name: N1-[5-cyano-1-(4-hydroxyphenyl)-3,4-bis(oxidanyl)pentan-2-yl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide Openeye Name: N1-[4-cyano-2,3-dihydroxy-1-[(4-hydroxyphenyl)methyl]butyl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide CAS Name: N1-[5-cyano-3,4-dihydroxy-1-(4-hydroxyphenyl)pentan-2-yl]-5-methyl-N3,N3-dipropylbenzene-1,3-dicarboxamide IUPAC Name: 1-N-[5-cyano-3,4-dihydroxy-1-(4-hydroxyphenyl)pentan-2-yl]-5-methyl-3-N,3-N-dipropylbenzene-1,3-dicarboxamide Traditional Name: N-[4-cyano-2,3-dihydroxy-1-(4-hydroxybenzyl)butyl]-5-methyl-N',N'-dipropyl-isophthalamide Formula: C27H35N3O5 MolecularWeight: 481.5839

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)C1=CC(=CC(=C1)C(=O)NC(CC2=CC=C(C=C2)O)C(C(CC#N)O)O)C

Isomeric SMILES

CCCN(CCC)C(=O)C1=CC(=CC(=C1)C(=O)NC(CC2=CC=C(C=C2)O)C(C(CC#N)O)O)C

InChI

InChI=1S/C27H35N3O5/c1-4-12-30(13-5-2)27(35)21-15-18(3)14-20(17-21)26(34)29-23(25(33)24(32)10-11-28)16-19-6-8-22(31)9-7-19/h6-9,14-15,17,23-25,31-33H,4-5,10,12-13,16H2,1-3H3,(H,29,34)