3-[2-[4-(phenoxymethyl)piperidin-1-yl]ethylamino]-4-phenylazanyl-cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[2-[4-(phenoxymethyl)piperidin-1-yl]ethylamino]-4-phenylazanyl-cyclobut-3-ene-1,2-dione Openeye Name: 3-anilino-4-[2-[4-(phenoxymethyl)-1-piperidyl]ethylamino]cyclobut-3-ene-1,2-dione CAS Name: 3-anilino-4-[2-[4-(phenoxymethyl)-1-piperidinyl]ethylamino]cyclobut-3-ene-1,2-dione IUPAC Name: 3-anilino-4-[2-[4-(phenoxymethyl)piperidin-1-yl]ethylamino]cyclobut-3-ene-1,2-dione Traditional Name: 3-anilino-4-[2-[4-(phenoxymethyl)piperidino]ethylamino]cyclobut-3-ene-1,2-quinone Formula: C24H27N3O3 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1COC2=CC=CC=C2)CCNC3=C(C(=O)C3=O)NC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1COC2=CC=CC=C2)CCNC3=C(C(=O)C3=O)NC4=CC=CC=C4

InChI

InChI=1S/C24H27N3O3/c28-23-21(22(24(23)29)26-19-7-3-1-4-8-19)25-13-16-27-14-11-18(12-15-27)17-30-20-9-5-2-6-10-20/h1-10,18,25-26H,11-17H2