N-[1-[[5-acetamido-7-methoxy-3,4-bis(oxidanyl)-1-phenyl-heptan-2-yl]amino]-1-oxidanylidene-octan-2-yl]pyridine-3-carboxamide

Systemtic Name: N-[1-[[5-acetamido-7-methoxy-3,4-bis(oxidanyl)-1-phenyl-heptan-2-yl]amino]-1-oxidanylidene-octan-2-yl]pyridine-3-carboxamide Openeye Name: N-[1-[(4-acetamido-1-benzyl-2,3-dihydroxy-6-methoxy-hexyl)carbamoyl]heptyl]pyridine-3-carboxamide CAS Name: N-[1-[(5-acetamido-3,4-dihydroxy-7-methoxy-1-phenylheptan-2-yl)amino]-1-oxooctan-2-yl]-3-pyridinecarboxamide IUPAC Name: N-[1-[(5-acetamido-3,4-dihydroxy-7-methoxy-1-phenylheptan-2-yl)amino]-1-oxooctan-2-yl]pyridine-3-carboxamide Traditional Name: N-[1-[(4-acetamido-1-benzyl-2,3-dihydroxy-6-methoxy-hexyl)carbamoyl]heptyl]nicotinamide Formula: C30H44N4O6 MolecularWeight: 556.69356

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)NC(CC1=CC=CC=C1)C(C(C(CCOC)NC(=O)C)O)O)NC(=O)C2=CN=CC=C2

Isomeric SMILES

CCCCCCC(C(=O)NC(CC1=CC=CC=C1)C(C(C(CCOC)NC(=O)C)O)O)NC(=O)C2=CN=CC=C2

InChI

InChI=1S/C30H44N4O6/c1-4-5-6-10-15-25(33-29(38)23-14-11-17-31-20-23)30(39)34-26(19-22-12-8-7-9-13-22)28(37)27(36)24(16-18-40-3)32-21(2)35/h7-9,11-14,17,20,24-28,36-37H,4-6,10,15-16,18-19H2,1-3H3,(H,32,35)(H,33,38)(H,34,39)