(E)-1-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-3-(4-propan-2-ylphenyl)prop-2-en-1-one

Systemtic Name: (E)-1-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-3-(4-propan-2-ylphenyl)prop-2-en-1-one Openeye Name: (E)-1-[4-(azepane-1-carbonyl)-1-piperidyl]-3-(4-isopropylphenyl)prop-2-en-1-one CAS Name: (E)-1-[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-3-(4-propan-2-ylphenyl)-2-propen-1-one IUPAC Name: (E)-1-[4-(azepane-1-carbonyl)piperidin-1-yl]-3-(4-propan-2-ylphenyl)prop-2-en-1-one Traditional Name: (E)-1-[4-(azepane-1-carbonyl)piperidino]-3-p-cumenyl-prop-2-en-1-one Formula: C24H34N2O2 MolecularWeight: 382.53896

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C=CC(=O)N2CCC(CC2)C(=O)N3CCCCCC3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)/C=C/C(=O)N2CCC(CC2)C(=O)N3CCCCCC3

InChI

InChI=1S/C24H34N2O2/c1-19(2)21-10-7-20(8-11-21)9-12-23(27)25-17-13-22(14-18-25)24(28)26-15-5-3-4-6-16-26/h7-12,19,22H,3-6,13-18H2,1-2H3/b12-9+