N-[1-[[5-benzamido-3,4-bis(oxidanyl)-1-phenyl-hexan-2-yl]amino]-1-oxidanylidene-5-propyl-octan-2-yl]pyridine-3-carboxamide

Systemtic Name: N-[1-[[5-benzamido-3,4-bis(oxidanyl)-1-phenyl-hexan-2-yl]amino]-1-oxidanylidene-5-propyl-octan-2-yl]pyridine-3-carboxamide Openeye Name: N-[1-[(4-benzamido-1-benzyl-2,3-dihydroxy-pentyl)carbamoyl]-4-propyl-heptyl]pyridine-3-carboxamide CAS Name: N-[1-[(5-benzamido-3,4-dihydroxy-1-phenylhexan-2-yl)amino]-1-oxo-5-propyloctan-2-yl]-3-pyridinecarboxamide IUPAC Name: N-[1-[(5-benzamido-3,4-dihydroxy-1-phenylhexan-2-yl)amino]-1-oxo-5-propyloctan-2-yl]pyridine-3-carboxamide Traditional Name: N-[1-[(4-benzamido-1-benzyl-2,3-dihydroxy-pentyl)carbamoyl]-4-propyl-heptyl]nicotinamide Formula: C36H48N4O5 MolecularWeight: 616.79012

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)CCC(C(=O)NC(CC1=CC=CC=C1)C(C(C(C)NC(=O)C2=CC=CC=C2)O)O)NC(=O)C3=CN=CC=C3

Isomeric SMILES

CCCC(CCC)CCC(C(=O)NC(CC1=CC=CC=C1)C(C(C(C)NC(=O)C2=CC=CC=C2)O)O)NC(=O)C3=CN=CC=C3

InChI

InChI=1S/C36H48N4O5/c1-4-13-26(14-5-2)20-21-30(39-35(44)29-19-12-22-37-24-29)36(45)40-31(23-27-15-8-6-9-16-27)33(42)32(41)25(3)38-34(43)28-17-10-7-11-18-28/h6-12,15-19,22,24-26,30-33,41-42H,4-5,13-14,20-21,23H2,1-3H3,(H,38,43)(H,39,44)(H,40,45)