3-(ethylamino)-4-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylamino]cyclobutane-1,2-dione

Systemtic Name: 3-(ethylamino)-4-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylamino]cyclobutane-1,2-dione Openeye Name: 3-(ethylamino)-4-[3-[3-(1-piperidylmethyl)phenoxy]propylamino]cyclobutane-1,2-dione CAS Name: 3-(ethylamino)-4-[3-[3-(1-piperidinylmethyl)phenoxy]propylamino]cyclobutane-1,2-dione IUPAC Name: 3-(ethylamino)-4-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylamino]cyclobutane-1,2-dione Traditional Name: 3-(ethylamino)-4-[3-[3-(piperidinomethyl)phenoxy]propylamino]cyclobutane-1,2-quinone Formula: C21H31N3O3 MolecularWeight: 373.48914

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1C(C(=O)C1=O)NCCCOC2=CC=CC(=C2)CN3CCCCC3

Isomeric SMILES

CCNC1C(C(=O)C1=O)NCCCOC2=CC=CC(=C2)CN3CCCCC3

InChI

InChI=1S/C21H31N3O3/c1-2-22-18-19(21(26)20(18)25)23-10-7-13-27-17-9-6-8-16(14-17)15-24-11-4-3-5-12-24/h6,8-9,14,18-19,22-23H,2-5,7,10-13,15H2,1H3