(E)-1-(4-cyclopentylcarbonyl-1,4-diazepan-1-yl)-3-(3-fluorophenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(4-cyclopentylcarbonyl-1,4-diazepan-1-yl)-3-(3-fluorophenyl)prop-2-en-1-one Openeye Name: (E)-1-[4-(cyclopentanecarbonyl)-1,4-diazepan-1-yl]-3-(3-fluorophenyl)prop-2-en-1-one CAS Name: (E)-1-[4-[cyclopentyl(oxo)methyl]-1,4-diazepan-1-yl]-3-(3-fluorophenyl)-2-propen-1-one IUPAC Name: (E)-1-[4-(cyclopentanecarbonyl)-1,4-diazepan-1-yl]-3-(3-fluorophenyl)prop-2-en-1-one Traditional Name: (E)-1-[4-(cyclopentanecarbonyl)-1,4-diazepan-1-yl]-3-(3-fluorophenyl)prop-2-en-1-one Formula: C20H25FN2O2 MolecularWeight: 344.423103

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)N2CCCN(CC2)C(=O)C=CC3=CC(=CC=C3)F

Isomeric SMILES

C1CCC(C1)C(=O)N2CCCN(CC2)C(=O)/C=C/C3=CC(=CC=C3)F

InChI

InChI=1S/C20H25FN2O2/c21-18-8-3-5-16(15-18)9-10-19(24)22-11-4-12-23(14-13-22)20(25)17-6-1-2-7-17/h3,5,8-10,15,17H,1-2,4,6-7,11-14H2/b10-9+