3-[[3-[4-(2-ethoxyphenyl)piperazin-1-yl]carbonylphenyl]amino]-2-propyl-3H-isoindol-1-one

Systemtic Name: 3-[[3-[4-(2-ethoxyphenyl)piperazin-1-yl]carbonylphenyl]amino]-2-propyl-3H-isoindol-1-one Openeye Name: 3-[3-[4-(2-ethoxyphenyl)piperazine-1-carbonyl]anilino]-2-propyl-isoindolin-1-one CAS Name: 3-[3-[[4-(2-ethoxyphenyl)-1-piperazinyl]-oxomethyl]anilino]-2-propyl-3H-isoindol-1-one IUPAC Name: 3-[3-[4-(2-ethoxyphenyl)piperazine-1-carbonyl]anilino]-2-propyl-3H-isoindol-1-one Traditional Name: 3-[3-(4-o-phenetylpiperazine-1-carbonyl)anilino]-2-propyl-isoindolin-1-one Formula: C30H34N4O3 MolecularWeight: 498.61596

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(C2=CC=CC=C2C1=O)NC3=CC=CC(=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5OCC

Isomeric SMILES

CCCN1C(C2=CC=CC=C2C1=O)NC3=CC=CC(=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5OCC

InChI

InChI=1S/C30H34N4O3/c1-3-16-34-28(24-12-5-6-13-25(24)30(34)36)31-23-11-9-10-22(21-23)29(35)33-19-17-32(18-20-33)26-14-7-8-15-27(26)37-4-2/h5-15,21,28,31H,3-4,16-20H2,1-2H3