[3-[4-[(5-ethyl-6-methyl-2-phenoxy-pyridin-3-yl)carbamoyl]piperazin-1-yl]phenyl] ethanoate

Systemtic Name: [3-[4-[(5-ethyl-6-methyl-2-phenoxy-pyridin-3-yl)carbamoyl]piperazin-1-yl]phenyl] ethanoate Openeye Name: [3-[4-[(5-ethyl-6-methyl-2-phenoxy-3-pyridyl)carbamoyl]piperazin-1-yl]phenyl] acetate CAS Name: acetic acid [3-[4-[[(5-ethyl-6-methyl-2-phenoxy-3-pyridinyl)amino]-oxomethyl]-1-piperazinyl]phenyl] ester IUPAC Name: [3-[4-[(5-ethyl-6-methyl-2-phenoxypyridin-3-yl)carbamoyl]piperazin-1-yl]phenyl] acetate Traditional Name: acetic acid [3-[4-[(5-ethyl-6-methyl-2-phenoxy-3-pyridyl)carbamoyl]piperazino]phenyl] ester Formula: C27H30N4O4 MolecularWeight: 474.5515

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(N=C1C)OC2=CC=CC=C2)NC(=O)N3CCN(CC3)C4=CC(=CC=C4)OC(=O)C

Isomeric SMILES

CCC1=CC(=C(N=C1C)OC2=CC=CC=C2)NC(=O)N3CCN(CC3)C4=CC(=CC=C4)OC(=O)C

InChI

InChI=1S/C27H30N4O4/c1-4-21-17-25(26(28-19(21)2)35-23-10-6-5-7-11-23)29-27(33)31-15-13-30(14-16-31)22-9-8-12-24(18-22)34-20(3)32/h5-12,17-18H,4,13-16H2,1-3H3,(H,29,33)