N-[[4-(diethylaminomethyl)phenyl]methyl]-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-oxidanylidene-butanamide

Systemtic Name: N-[[4-(diethylaminomethyl)phenyl]methyl]-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-oxidanylidene-butanamide Openeye Name: N-[[4-(diethylaminomethyl)phenyl]methyl]-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-oxo-butanamide CAS Name: N-[[4-(diethylaminomethyl)phenyl]methyl]-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-oxobutanamide IUPAC Name: N-[[4-(diethylaminomethyl)phenyl]methyl]-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-oxobutanamide Traditional Name: N-[4-(diethylaminomethyl)benzyl]-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-keto-butyramide Formula: C25H32N2O4 MolecularWeight: 424.53258

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC=C(C=C1)CNC(=O)CCC(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CCN(CC)CC1=CC=C(C=C1)CNC(=O)CCC(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C25H32N2O4/c1-3-27(4-2)18-20-8-6-19(7-9-20)17-26-25(29)13-11-22(28)21-10-12-23-24(16-21)31-15-5-14-30-23/h6-10,12,16H,3-5,11,13-15,17-18H2,1-2H3,(H,26,29)