[2-methyl-3-[(4-methylpiperazin-1-yl)carbamoyl]benzo[g][1]benzofuran-5-yl] ethanoate

Systemtic Name: [2-methyl-3-[(4-methylpiperazin-1-yl)carbamoyl]benzo[g][1]benzofuran-5-yl] ethanoate Openeye Name: [2-methyl-3-[(4-methylpiperazin-1-yl)carbamoyl]benzo[g]benzofuran-5-yl] acetate CAS Name: acetic acid [2-methyl-3-[[(4-methyl-1-piperazinyl)amino]-oxomethyl]-5-benzo[g]benzofuranyl] ester IUPAC Name: [2-methyl-3-[(4-methylpiperazin-1-yl)carbamoyl]benzo[g][1]benzofuran-5-yl] acetate Traditional Name: acetic acid [2-methyl-3-[(4-methylpiperazino)carbamoyl]benzo[g]benzofuran-5-yl] ester Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)C3=CC=CC=C3C(=C2)OC(=O)C)C(=O)NN4CCN(CC4)C

Isomeric SMILES

CC1=C(C2=C(O1)C3=CC=CC=C3C(=C2)OC(=O)C)C(=O)NN4CCN(CC4)C

InChI

InChI=1S/C21H23N3O4/c1-13-19(21(26)22-24-10-8-23(3)9-11-24)17-12-18(28-14(2)25)15-6-4-5-7-16(15)20(17)27-13/h4-7,12H,8-11H2,1-3H3,(H,22,26)