3-[[4-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]carbonylphenyl]amino]-2-propan-2-yl-3H-isoindol-1-one

Systemtic Name: 3-[[4-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]carbonylphenyl]amino]-2-propan-2-yl-3H-isoindol-1-one Openeye Name: 3-[4-[4-[(E)-cinnamyl]piperazine-1-carbonyl]anilino]-2-isopropyl-isoindolin-1-one CAS Name: 3-[4-[oxo-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]methyl]anilino]-2-propan-2-yl-3H-isoindol-1-one IUPAC Name: 3-[4-[4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbonyl]anilino]-2-propan-2-yl-3H-isoindol-1-one Traditional Name: 3-[4-[4-[(E)-cinnamyl]piperazine-1-carbonyl]anilino]-2-isopropyl-isoindolin-1-one Formula: C31H34N4O2 MolecularWeight: 494.62726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(C2=CC=CC=C2C1=O)NC3=CC=C(C=C3)C(=O)N4CCN(CC4)CC=CC5=CC=CC=C5

Isomeric SMILES

CC(C)N1C(C2=CC=CC=C2C1=O)NC3=CC=C(C=C3)C(=O)N4CCN(CC4)C/C=C/C5=CC=CC=C5

InChI

InChI=1S/C31H34N4O2/c1-23(2)35-29(27-12-6-7-13-28(27)31(35)37)32-26-16-14-25(15-17-26)30(36)34-21-19-33(20-22-34)18-8-11-24-9-4-3-5-10-24/h3-17,23,29,32H,18-22H2,1-2H3/b11-8+