N-[3-[(E)-3-(1,4-diazepan-1-yl)-3-oxidanylidene-prop-1-enyl]phenyl]-3,4-dimethoxy-benzamide

Systemtic Name: N-[3-[(E)-3-(1,4-diazepan-1-yl)-3-oxidanylidene-prop-1-enyl]phenyl]-3,4-dimethoxy-benzamide Openeye Name: N-[3-[(E)-3-(1,4-diazepan-1-yl)-3-oxo-prop-1-enyl]phenyl]-3,4-dimethoxy-benzamide CAS Name: N-[3-[(E)-3-(1,4-diazepan-1-yl)-3-oxoprop-1-enyl]phenyl]-3,4-dimethoxybenzamide IUPAC Name: N-[3-[(E)-3-(1,4-diazepan-1-yl)-3-oxoprop-1-enyl]phenyl]-3,4-dimethoxybenzamide Traditional Name: N-[3-[(E)-3-(1,4-diazepan-1-yl)-3-keto-prop-1-enyl]phenyl]-3,4-dimethoxy-benzamide Formula: C23H27N3O4 MolecularWeight: 409.47818

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)C=CC(=O)N3CCCNCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)/C=C/C(=O)N3CCCNCC3)OC

InChI

InChI=1S/C23H27N3O4/c1-29-20-9-8-18(16-21(20)30-2)23(28)25-19-6-3-5-17(15-19)7-10-22(27)26-13-4-11-24-12-14-26/h3,5-10,15-16,24H,4,11-14H2,1-2H3,(H,25,28)/b10-7+