N-[1-azanyl-1,2-bis(oxidanylidene)heptan-3-yl]-2-[(E)-2-[3-(azepan-1-yl)-2-methyl-phenyl]ethenyl]benzamide

Systemtic Name: N-[1-azanyl-1,2-bis(oxidanylidene)heptan-3-yl]-2-[(E)-2-[3-(azepan-1-yl)-2-methyl-phenyl]ethenyl]benzamide Openeye Name: 2-[(E)-2-[3-(azepan-1-yl)-2-methyl-phenyl]vinyl]-N-(1-oxamoylpentyl)benzamide CAS Name: N-(1-amino-1,2-dioxoheptan-3-yl)-2-[(E)-2-[3-(1-azepanyl)-2-methylphenyl]ethenyl]benzamide IUPAC Name: N-(1-amino-1,2-dioxoheptan-3-yl)-2-[(E)-2-[3-(azepan-1-yl)-2-methylphenyl]ethenyl]benzamide Traditional Name: 2-[(E)-2-[3-(azepan-1-yl)-2-methyl-phenyl]vinyl]-N-(1-oxamoylpentyl)benzamide Formula: C29H37N3O3 MolecularWeight: 475.62238

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)C(=O)N)NC(=O)C1=CC=CC=C1C=CC2=C(C(=CC=C2)N3CCCCCC3)C

Isomeric SMILES

CCCCC(C(=O)C(=O)N)NC(=O)C1=CC=CC=C1/C=C/C2=C(C(=CC=C2)N3CCCCCC3)C

InChI

InChI=1S/C29H37N3O3/c1-3-4-15-25(27(33)28(30)34)31-29(35)24-14-8-7-12-23(24)18-17-22-13-11-16-26(21(22)2)32-19-9-5-6-10-20-32/h7-8,11-14,16-18,25H,3-6,9-10,15,19-20H2,1-2H3,(H2,30,34)(H,31,35)/b18-17+