3-[3-[3-(azonan-1-ylmethyl)phenoxy]propylamino]-4-methoxy-cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[3-[3-(azonan-1-ylmethyl)phenoxy]propylamino]-4-methoxy-cyclobut-3-ene-1,2-dione Openeye Name: 3-[3-[3-(azonan-1-ylmethyl)phenoxy]propylamino]-4-methoxy-cyclobut-3-ene-1,2-dione CAS Name: 3-[3-[3-(1-azonanylmethyl)phenoxy]propylamino]-4-methoxycyclobut-3-ene-1,2-dione IUPAC Name: 3-[3-[3-(azonan-1-ylmethyl)phenoxy]propylamino]-4-methoxycyclobut-3-ene-1,2-dione Traditional Name: 3-[3-[3-(azonan-1-ylmethyl)phenoxy]propylamino]-4-methoxy-cyclobut-3-ene-1,2-quinone Formula: C23H32N2O4 MolecularWeight: 400.51118

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=O)C1=O)NCCCOC2=CC=CC(=C2)CN3CCCCCCCC3

Isomeric SMILES

COC1=C(C(=O)C1=O)NCCCOC2=CC=CC(=C2)CN3CCCCCCCC3

InChI

InChI=1S/C23H32N2O4/c1-28-23-20(21(26)22(23)27)24-12-9-15-29-19-11-8-10-18(16-19)17-25-13-6-4-2-3-5-7-14-25/h8,10-11,16,24H,2-7,9,12-15,17H2,1H3