N1-[7-cyano-1-(4-hydroxyphenyl)-3,4-bis(oxidanyl)heptan-2-yl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide

Systemtic Name: N1-[7-cyano-1-(4-hydroxyphenyl)-3,4-bis(oxidanyl)heptan-2-yl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide Openeye Name: N1-[6-cyano-2,3-dihydroxy-1-[(4-hydroxyphenyl)methyl]hexyl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide CAS Name: N1-[7-cyano-3,4-dihydroxy-1-(4-hydroxyphenyl)heptan-2-yl]-5-methyl-N3,N3-dipropylbenzene-1,3-dicarboxamide IUPAC Name: 1-N-[7-cyano-3,4-dihydroxy-1-(4-hydroxyphenyl)heptan-2-yl]-5-methyl-3-N,3-N-dipropylbenzene-1,3-dicarboxamide Traditional Name: N-[6-cyano-2,3-dihydroxy-1-(4-hydroxybenzyl)hexyl]-5-methyl-N',N'-dipropyl-isophthalamide Formula: C29H39N3O5 MolecularWeight: 509.63706

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(CCCC#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(CCCC#N)O)O)C

InChI

InChI=1S/C29H39N3O5/c1-4-14-32(15-5-2)29(37)23-17-20(3)16-22(19-23)28(36)31-25(18-21-9-11-24(33)12-10-21)27(35)26(34)8-6-7-13-30/h9-12,16-17,19,25-27,33-35H,4-8,14-15,18H2,1-3H3,(H,31,36)