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

Systemtic Name: 3-[[3-[4-(4-nitrophenyl)piperazin-1-yl]carbonylphenyl]amino]-2-(oxolan-2-ylmethyl)-3H-isoindol-1-one Openeye Name: 3-[3-[4-(4-nitrophenyl)piperazine-1-carbonyl]anilino]-2-(tetrahydrofuran-2-ylmethyl)isoindolin-1-one CAS Name: 3-[3-[[4-(4-nitrophenyl)-1-piperazinyl]-oxomethyl]anilino]-2-(2-oxolanylmethyl)-3H-isoindol-1-one IUPAC Name: 3-[3-[4-(4-nitrophenyl)piperazine-1-carbonyl]anilino]-2-(oxolan-2-ylmethyl)-3H-isoindol-1-one Traditional Name: 3-[3-[4-(4-nitrophenyl)piperazine-1-carbonyl]anilino]-2-(tetrahydrofurfuryl)isoindolin-1-one Formula: C30H31N5O5 MolecularWeight: 541.59764

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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)C6=CC=C(C=C6)[N+](=O)[O-]

Isomeric SMILES

C1CC(OC1)CN2C(C3=CC=CC=C3C2=O)NC4=CC=CC(=C4)C(=O)N5CCN(CC5)C6=CC=C(C=C6)[N+](=O)[O-]

InChI

InChI=1S/C30H31N5O5/c36-29(33-16-14-32(15-17-33)23-10-12-24(13-11-23)35(38)39)21-5-3-6-22(19-21)31-28-26-8-1-2-9-27(26)30(37)34(28)20-25-7-4-18-40-25/h1-3,5-6,8-13,19,25,28,31H,4,7,14-18,20H2