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

Systemtic Name: N1-[5-methoxy-3,4-bis(oxidanyl)-1-phenyl-pentan-2-yl]-N3,N3-dipropyl-benzene-1,3,5-tricarboxamide Openeye Name: N1-(1-benzyl-2,3-dihydroxy-4-methoxy-butyl)-N3,N3-dipropyl-benzene-1,3,5-tricarboxamide CAS Name: N1-(3,4-dihydroxy-5-methoxy-1-phenylpentan-2-yl)-N3,N3-dipropylbenzene-1,3,5-tricarboxamide IUPAC Name: 1-N-(3,4-dihydroxy-5-methoxy-1-phenylpentan-2-yl)-3-N,3-N-dipropylbenzene-1,3,5-tricarboxamide Traditional Name: N1-(1-benzyl-2,3-dihydroxy-4-methoxy-butyl)-N3,N3-dipropyl-benzene-1,3,5-tricarboxamide Formula: C27H37N3O6 MolecularWeight: 499.59918

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H37N3O6/c1-4-11-30(12-5-2)27(35)21-15-19(25(28)33)14-20(16-21)26(34)29-22(24(32)23(31)17-36-3)13-18-9-7-6-8-10-18/h6-10,14-16,22-24,31-32H,4-5,11-13,17H2,1-3H3,(H2,28,33)(H,29,34)