[1-(2-aminocarbonyl-4-methyl-pyridin-3-yl)-3-(4-chloranylbutyl)indol-5-yl] hydrogen carbonate

Systemtic Name: [1-(2-aminocarbonyl-4-methyl-pyridin-3-yl)-3-(4-chloranylbutyl)indol-5-yl] hydrogen carbonate Openeye Name: [1-(2-carbamoyl-4-methyl-3-pyridyl)-3-(4-chlorobutyl)indol-5-yl] hydrogen carbonate CAS Name: carbonic acid [1-(2-carbamoyl-4-methyl-3-pyridinyl)-3-(4-chlorobutyl)-5-indolyl] ester IUPAC Name: [1-(2-carbamoyl-4-methylpyridin-3-yl)-3-(4-chlorobutyl)indol-5-yl] hydrogen carbonate Traditional Name: carbonic acid [1-(2-carbamoyl-4-methyl-3-pyridyl)-3-(4-chlorobutyl)indol-5-yl] ester Formula: C20H20ClN3O4 MolecularWeight: 401.8435

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC=C1)C(=O)N)N2C=C(C3=C2C=CC(=C3)OC(=O)O)CCCCCl

Isomeric SMILES

CC1=C(C(=NC=C1)C(=O)N)N2C=C(C3=C2C=CC(=C3)OC(=O)O)CCCCCl

InChI

InChI=1S/C20H20ClN3O4/c1-12-7-9-23-17(19(22)25)18(12)24-11-13(4-2-3-8-21)15-10-14(28-20(26)27)5-6-16(15)24/h5-7,9-11H,2-4,8H2,1H3,(H2,22,25)(H,26,27)