3-(1H-indol-3-yl)-4-phenylazanyl-1-[3-[4-(phenylmethyl)piperidin-1-yl]propyl]pyrrole-2,5-dione

Systemtic Name: 3-(1H-indol-3-yl)-4-phenylazanyl-1-[3-[4-(phenylmethyl)piperidin-1-yl]propyl]pyrrole-2,5-dione Openeye Name: 3-anilino-1-[3-(4-benzyl-1-piperidyl)propyl]-4-(1H-indol-3-yl)pyrrole-2,5-dione CAS Name: 3-anilino-4-(1H-indol-3-yl)-1-[3-[4-(phenylmethyl)-1-piperidinyl]propyl]pyrrole-2,5-dione IUPAC Name: 3-anilino-1-[3-(4-benzylpiperidin-1-yl)propyl]-4-(1H-indol-3-yl)pyrrole-2,5-dione Traditional Name: 3-anilino-1-[3-(4-benzylpiperidino)propyl]-4-(1H-indol-3-yl)-3-pyrroline-2,5-quinone Formula: C33H34N4O2 MolecularWeight: 518.64866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)CCCN3C(=O)C(=C(C3=O)NC4=CC=CC=C4)C5=CNC6=CC=CC=C65

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)CCCN3C(=O)C(=C(C3=O)NC4=CC=CC=C4)C5=CNC6=CC=CC=C65

InChI

InChI=1S/C33H34N4O2/c38-32-30(28-23-34-29-15-8-7-14-27(28)29)31(35-26-12-5-2-6-13-26)33(39)37(32)19-9-18-36-20-16-25(17-21-36)22-24-10-3-1-4-11-24/h1-8,10-15,23,25,34-35H,9,16-22H2