N1-[5-methoxy-3,4-bis(oxidanyl)-1-pyridin-4-yl-pentan-2-yl]-N3,N3-dipropyl-benzene-1,3,5-tricarboxamide

Systemtic Name: N1-[5-methoxy-3,4-bis(oxidanyl)-1-pyridin-4-yl-pentan-2-yl]-N3,N3-dipropyl-benzene-1,3,5-tricarboxamide Openeye Name: N1-[2,3-dihydroxy-4-methoxy-1-(4-pyridylmethyl)butyl]-N3,N3-dipropyl-benzene-1,3,5-tricarboxamide CAS Name: N1-(3,4-dihydroxy-5-methoxy-1-pyridin-4-ylpentan-2-yl)-N3,N3-dipropylbenzene-1,3,5-tricarboxamide IUPAC Name: 1-N-(3,4-dihydroxy-5-methoxy-1-pyridin-4-ylpentan-2-yl)-3-N,3-N-dipropylbenzene-1,3,5-tricarboxamide Traditional Name: N1-[2,3-dihydroxy-4-methoxy-1-(4-pyridylmethyl)butyl]-N3,N3-dipropyl-benzene-1,3,5-tricarboxamide Formula: C26H36N4O6 MolecularWeight: 500.58724

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H36N4O6/c1-4-10-30(11-5-2)26(35)20-14-18(24(27)33)13-19(15-20)25(34)29-21(23(32)22(31)16-36-3)12-17-6-8-28-9-7-17/h6-9,13-15,21-23,31-32H,4-5,10-12,16H2,1-3H3,(H2,27,33)(H,29,34)