N-[4-[[4-(azepan-1-yl)-4-oxidanylidene-butanoyl]amino]-2,5-dimethoxy-phenyl]benzamide

Systemtic Name: N-[4-[[4-(azepan-1-yl)-4-oxidanylidene-butanoyl]amino]-2,5-dimethoxy-phenyl]benzamide Openeye Name: N-[4-[[4-(azepan-1-yl)-4-oxo-butanoyl]amino]-2,5-dimethoxy-phenyl]benzamide CAS Name: N-[4-[[4-(1-azepanyl)-1,4-dioxobutyl]amino]-2,5-dimethoxyphenyl]benzamide IUPAC Name: N-[4-[[4-(azepan-1-yl)-4-oxobutanoyl]amino]-2,5-dimethoxyphenyl]benzamide Traditional Name: N-[4-[[4-(azepan-1-yl)-4-keto-butanoyl]amino]-2,5-dimethoxy-phenyl]benzamide Formula: C25H31N3O5 MolecularWeight: 453.53074

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OC)NC(=O)CCC(=O)N3CCCCCC3

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OC)NC(=O)CCC(=O)N3CCCCCC3

InChI

InChI=1S/C25H31N3O5/c1-32-21-17-20(27-25(31)18-10-6-5-7-11-18)22(33-2)16-19(21)26-23(29)12-13-24(30)28-14-8-3-4-9-15-28/h5-7,10-11,16-17H,3-4,8-9,12-15H2,1-2H3,(H,26,29)(H,27,31)