N1-[6-cyano-1-(4-hydroxyphenyl)-3,4-bis(oxidanyl)hexan-2-yl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide

Systemtic Name: N1-[6-cyano-1-(4-hydroxyphenyl)-3,4-bis(oxidanyl)hexan-2-yl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide Openeye Name: N1-[5-cyano-2,3-dihydroxy-1-[(4-hydroxyphenyl)methyl]pentyl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide CAS Name: N1-[6-cyano-3,4-dihydroxy-1-(4-hydroxyphenyl)hexan-2-yl]-5-methyl-N3,N3-dipropylbenzene-1,3-dicarboxamide IUPAC Name: 1-N-[6-cyano-3,4-dihydroxy-1-(4-hydroxyphenyl)hexan-2-yl]-5-methyl-3-N,3-N-dipropylbenzene-1,3-dicarboxamide Traditional Name: N-[5-cyano-2,3-dihydroxy-1-(4-hydroxybenzyl)pentyl]-5-methyl-N',N'-dipropyl-isophthalamide Formula: C28H37N3O5 MolecularWeight: 495.61048

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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(CCC#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(CCC#N)O)O)C

InChI

InChI=1S/C28H37N3O5/c1-4-13-31(14-5-2)28(36)22-16-19(3)15-21(18-22)27(35)30-24(26(34)25(33)7-6-12-29)17-20-8-10-23(32)11-9-20/h8-11,15-16,18,24-26,32-34H,4-7,13-14,17H2,1-3H3,(H,30,35)