5-[4-[(diphenylamino)methyl]piperidin-1-yl]-4-propyl-isoindole-1,3-dione

Systemtic Name: 5-[4-[(diphenylamino)methyl]piperidin-1-yl]-4-propyl-isoindole-1,3-dione Openeye Name: 5-[4-[(N-phenylanilino)methyl]-1-piperidyl]-4-propyl-isoindoline-1,3-dione CAS Name: 5-[4-[(N-phenylanilino)methyl]-1-piperidinyl]-4-propylisoindole-1,3-dione IUPAC Name: 5-[4-[(N-phenylanilino)methyl]piperidin-1-yl]-4-propylisoindole-1,3-dione Traditional Name: 5-[4-[(N-phenylanilino)methyl]piperidino]-4-propyl-isoindoline-1,3-quinone Formula: C29H31N3O2 MolecularWeight: 453.57534

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1C(=O)NC2=O)N3CCC(CC3)CN(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCCC1=C(C=CC2=C1C(=O)NC2=O)N3CCC(CC3)CN(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H31N3O2/c1-2-9-24-26(15-14-25-27(24)29(34)30-28(25)33)31-18-16-21(17-19-31)20-32(22-10-5-3-6-11-22)23-12-7-4-8-13-23/h3-8,10-15,21H,2,9,16-20H2,1H3,(H,30,33,34)