[(4-carbamimidoylphenyl)amino] 2-[3-ethoxy-5-(1-methylsulfonylpiperidin-4-yl)oxy-phenyl]ethanoate

Systemtic Name: [(4-carbamimidoylphenyl)amino] 2-[3-ethoxy-5-(1-methylsulfonylpiperidin-4-yl)oxy-phenyl]ethanoate Openeye Name: (4-carbamimidoylanilino) 2-[3-ethoxy-5-[(1-methylsulfonyl-4-piperidyl)oxy]phenyl]acetate CAS Name: 2-[3-ethoxy-5-[(1-methylsulfonyl-4-piperidinyl)oxy]phenyl]acetic acid (4-carbamimidoylanilino) ester IUPAC Name: (4-carbamimidoylanilino) 2-[3-ethoxy-5-(1-methylsulfonylpiperidin-4-yl)oxyphenyl]acetate Traditional Name: 2-[3-ethoxy-5-[(1-mesyl-4-piperidyl)oxy]phenyl]acetic acid (4-amidinoanilino) ester Formula: C23H30N4O6S MolecularWeight: 490.5725

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1)OC2CCN(CC2)S(=O)(=O)C)CC(=O)ONC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CCOC1=CC(=CC(=C1)OC2CCN(CC2)S(=O)(=O)C)CC(=O)ONC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C23H30N4O6S/c1-3-31-20-12-16(14-22(28)33-26-18-6-4-17(5-7-18)23(24)25)13-21(15-20)32-19-8-10-27(11-9-19)34(2,29)30/h4-7,12-13,15,19,26H,3,8-11,14H2,1-2H3,(H3,24,25)