3-[[3-[4-(diphenylmethyl)piperazin-1-yl]carbonylphenyl]amino]-2-(oxolan-2-ylmethyl)-3H-isoindol-1-one

Systemtic Name: 3-[[3-[4-(diphenylmethyl)piperazin-1-yl]carbonylphenyl]amino]-2-(oxolan-2-ylmethyl)-3H-isoindol-1-one Openeye Name: 3-[3-(4-benzhydrylpiperazine-1-carbonyl)anilino]-2-(tetrahydrofuran-2-ylmethyl)isoindolin-1-one CAS Name: 3-[3-[[4-(diphenylmethyl)-1-piperazinyl]-oxomethyl]anilino]-2-(2-oxolanylmethyl)-3H-isoindol-1-one IUPAC Name: 3-[3-(4-benzhydrylpiperazine-1-carbonyl)anilino]-2-(oxolan-2-ylmethyl)-3H-isoindol-1-one Traditional Name: 3-[3-(4-benzhydrylpiperazine-1-carbonyl)anilino]-2-(tetrahydrofurfuryl)isoindolin-1-one Formula: C37H38N4O3 MolecularWeight: 586.72262

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(C3=CC=CC=C3C2=O)NC4=CC=CC(=C4)C(=O)N5CCN(CC5)C(C6=CC=CC=C6)C7=CC=CC=C7

Isomeric SMILES

C1CC(OC1)CN2C(C3=CC=CC=C3C2=O)NC4=CC=CC(=C4)C(=O)N5CCN(CC5)C(C6=CC=CC=C6)C7=CC=CC=C7

InChI

InChI=1S/C37H38N4O3/c42-36(40-22-20-39(21-23-40)34(27-11-3-1-4-12-27)28-13-5-2-6-14-28)29-15-9-16-30(25-29)38-35-32-18-7-8-19-33(32)37(43)41(35)26-31-17-10-24-44-31/h1-9,11-16,18-19,25,31,34-35,38H,10,17,20-24,26H2