(2E)-1-[5-(3,5-dimethoxy-4-propan-2-yloxy-phenyl)-1,4-diazepan-1-yl]penta-2,4-dien-1-one

Systemtic Name: (2E)-1-[5-(3,5-dimethoxy-4-propan-2-yloxy-phenyl)-1,4-diazepan-1-yl]penta-2,4-dien-1-one Openeye Name: (2E)-1-[5-(4-isopropoxy-3,5-dimethoxy-phenyl)-1,4-diazepan-1-yl]penta-2,4-dien-1-one CAS Name: (2E)-1-[5-(3,5-dimethoxy-4-propan-2-yloxyphenyl)-1,4-diazepan-1-yl]-1-penta-2,4-dienone IUPAC Name: (2E)-1-[5-(3,5-dimethoxy-4-propan-2-yloxyphenyl)-1,4-diazepan-1-yl]penta-2,4-dien-1-one Traditional Name: (2E)-1-[5-(4-isopropoxy-3,5-dimethoxy-phenyl)-1,4-diazepan-1-yl]penta-2,4-dien-1-one Formula: C21H30N2O4 MolecularWeight: 374.4739

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1OC)C2CCN(CCN2)C(=O)C=CC=C)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1OC)C2CCN(CCN2)C(=O)/C=C/C=C)OC

InChI

InChI=1S/C21H30N2O4/c1-6-7-8-20(24)23-11-9-17(22-10-12-23)16-13-18(25-4)21(27-15(2)3)19(14-16)26-5/h6-8,13-15,17,22H,1,9-12H2,2-5H3/b8-7+