3-azanyl-4-[3-[4-(diphenylmethyl)oxypiperidin-1-yl]propylamino]cyclobut-3-ene-1,2-dione

Systemtic Name: 3-azanyl-4-[3-[4-(diphenylmethyl)oxypiperidin-1-yl]propylamino]cyclobut-3-ene-1,2-dione Openeye Name: 3-amino-4-[3-(4-benzhydryloxy-1-piperidyl)propylamino]cyclobut-3-ene-1,2-dione CAS Name: 3-amino-4-[3-[4-(diphenylmethyl)oxy-1-piperidinyl]propylamino]cyclobut-3-ene-1,2-dione IUPAC Name: 3-amino-4-[3-(4-benzhydryloxypiperidin-1-yl)propylamino]cyclobut-3-ene-1,2-dione Traditional Name: 3-amino-4-[3-(4-benzhydryloxypiperidino)propylamino]cyclobut-3-ene-1,2-quinone Formula: C25H29N3O3 MolecularWeight: 419.51606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OC(C2=CC=CC=C2)C3=CC=CC=C3)CCCNC4=C(C(=O)C4=O)N

Isomeric SMILES

C1CN(CCC1OC(C2=CC=CC=C2)C3=CC=CC=C3)CCCNC4=C(C(=O)C4=O)N

InChI

InChI=1S/C25H29N3O3/c26-21-22(24(30)23(21)29)27-14-7-15-28-16-12-20(13-17-28)31-25(18-8-3-1-4-9-18)19-10-5-2-6-11-19/h1-6,8-11,20,25,27H,7,12-17,26H2