4-[2-[[6-(1-ethanimidoylpiperidin-4-yl)oxy-2-oxidanylidene-quinolin-1-yl]methyl]phenyl]benzenecarboximidamide

Systemtic Name: 4-[2-[[6-(1-ethanimidoylpiperidin-4-yl)oxy-2-oxidanylidene-quinolin-1-yl]methyl]phenyl]benzenecarboximidamide Openeye Name: 4-[2-[[6-[(1-ethanimidoyl-4-piperidyl)oxy]-2-oxo-1-quinolyl]methyl]phenyl]benzamidine CAS Name: 4-[2-[[6-[[1-(1-iminoethyl)-4-piperidinyl]oxy]-2-oxo-1-quinolinyl]methyl]phenyl]benzenecarboximidamide IUPAC Name: 4-[2-[[6-(1-ethanimidoylpiperidin-4-yl)oxy-2-oxoquinolin-1-yl]methyl]phenyl]benzenecarboximidamide Traditional Name: 4-[2-[[6-[(1-acetimidoyl-4-piperidyl)oxy]-2-keto-1-quinolyl]methyl]phenyl]benzamidine Formula: C30H31N5O2 MolecularWeight: 493.59944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=N)N1CCC(CC1)OC2=CC3=C(C=C2)N(C(=O)C=C3)CC4=CC=CC=C4C5=CC=C(C=C5)C(=N)N

Isomeric SMILES

CC(=N)N1CCC(CC1)OC2=CC3=C(C=C2)N(C(=O)C=C3)CC4=CC=CC=C4C5=CC=C(C=C5)C(=N)N

InChI

InChI=1S/C30H31N5O2/c1-20(31)34-16-14-25(15-17-34)37-26-11-12-28-23(18-26)10-13-29(36)35(28)19-24-4-2-3-5-27(24)21-6-8-22(9-7-21)30(32)33/h2-13,18,25,31H,14-17,19H2,1H3,(H3,32,33)