N-[2-[2-(1,4-diazepan-1-yl)-2-oxidanylidene-ethyl]phenyl]-3,4-dimethoxy-benzamide

Systemtic Name: N-[2-[2-(1,4-diazepan-1-yl)-2-oxidanylidene-ethyl]phenyl]-3,4-dimethoxy-benzamide Openeye Name: N-[2-[2-(1,4-diazepan-1-yl)-2-oxo-ethyl]phenyl]-3,4-dimethoxy-benzamide CAS Name: N-[2-[2-(1,4-diazepan-1-yl)-2-oxoethyl]phenyl]-3,4-dimethoxybenzamide IUPAC Name: N-[2-[2-(1,4-diazepan-1-yl)-2-oxoethyl]phenyl]-3,4-dimethoxybenzamide Traditional Name: N-[2-[2-(1,4-diazepan-1-yl)-2-keto-ethyl]phenyl]-3,4-dimethoxy-benzamide Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2CC(=O)N3CCCNCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2CC(=O)N3CCCNCC3)OC

InChI

InChI=1S/C22H27N3O4/c1-28-19-9-8-17(14-20(19)29-2)22(27)24-18-7-4-3-6-16(18)15-21(26)25-12-5-10-23-11-13-25/h3-4,6-9,14,23H,5,10-13,15H2,1-2H3,(H,24,27)