N1-[1-(4-hydroxyphenyl)-3,4-bis(oxidanyl)non-8-yn-2-yl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide

Systemtic Name: N1-[1-(4-hydroxyphenyl)-3,4-bis(oxidanyl)non-8-yn-2-yl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide Openeye Name: N1-[2,3-dihydroxy-1-[(4-hydroxyphenyl)methyl]oct-7-ynyl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide CAS Name: N1-[3,4-dihydroxy-1-(4-hydroxyphenyl)non-8-yn-2-yl]-5-methyl-N3,N3-dipropylbenzene-1,3-dicarboxamide IUPAC Name: 1-N-[3,4-dihydroxy-1-(4-hydroxyphenyl)non-8-yn-2-yl]-5-methyl-3-N,3-N-dipropylbenzene-1,3-dicarboxamide Traditional Name: N-[2,3-dihydroxy-1-(4-hydroxybenzyl)oct-7-ynyl]-5-methyl-N',N'-dipropyl-isophthalamide Formula: C30H40N2O5 MolecularWeight: 508.649

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

InChI

InChI=1S/C30H40N2O5/c1-5-8-9-10-27(34)28(35)26(19-22-11-13-25(33)14-12-22)31-29(36)23-17-21(4)18-24(20-23)30(37)32(15-6-2)16-7-3/h1,11-14,17-18,20,26-28,33-35H,6-10,15-16,19H2,2-4H3,(H,31,36)