(E)-2-[4-methylpentanoyl-(octylamino)amino]-N-(oxan-2-yloxy)-5-phenyl-pent-4-enamide

Systemtic Name: (E)-2-[4-methylpentanoyl-(octylamino)amino]-N-(oxan-2-yloxy)-5-phenyl-pent-4-enamide Openeye Name: (E)-2-[4-methylpentanoyl-(octylamino)amino]-5-phenyl-N-tetrahydropyran-2-yloxy-pent-4-enamide CAS Name: (E)-2-[(4-methyl-1-oxopentyl)-(octylamino)amino]-N-(2-oxanyloxy)-5-phenyl-4-pentenamide IUPAC Name: (E)-2-[4-methylpentanoyl-(octylamino)amino]-N-(oxan-2-yloxy)-5-phenylpent-4-enamide Traditional Name: (E)-2-[4-methylpentanoyl-(octylamino)amino]-5-phenyl-N-tetrahydropyran-2-yloxy-pent-4-enamide Formula: C30H49N3O4 MolecularWeight: 515.72776

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNN(C(CC=CC1=CC=CC=C1)C(=O)NOC2CCCCO2)C(=O)CCC(C)C

Isomeric SMILES

CCCCCCCCNN(C(C/C=C/C1=CC=CC=C1)C(=O)NOC2CCCCO2)C(=O)CCC(C)C

InChI

InChI=1S/C30H49N3O4/c1-4-5-6-7-8-13-23-31-33(28(34)22-21-25(2)3)27(19-15-18-26-16-10-9-11-17-26)30(35)32-37-29-20-12-14-24-36-29/h9-11,15-18,25,27,29,31H,4-8,12-14,19-24H2,1-3H3,(H,32,35)/b18-15+