[1-oxidanylidene-1-(1,2,3,4-tetrahydrocarbazol-9-yl)propan-2-yl] 2-chloranylpyridine-4-carboxylate

Systemtic Name: [1-oxidanylidene-1-(1,2,3,4-tetrahydrocarbazol-9-yl)propan-2-yl] 2-chloranylpyridine-4-carboxylate Openeye Name: [1-methyl-2-oxo-2-(1,2,3,4-tetrahydrocarbazol-9-yl)ethyl] 2-chloropyridine-4-carboxylate CAS Name: 2-chloro-4-pyridinecarboxylic acid [1-oxo-1-(1,2,3,4-tetrahydrocarbazol-9-yl)propan-2-yl] ester IUPAC Name: [1-oxo-1-(1,2,3,4-tetrahydrocarbazol-9-yl)propan-2-yl] 2-chloropyridine-4-carboxylate Traditional Name: 2-chloroisonicotinic acid [2-keto-1-methyl-2-(1,2,3,4-tetrahydrocarbazol-9-yl)ethyl] ester Formula: C21H19ClN2O3 MolecularWeight: 382.84016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1C2=C(CCCC2)C3=CC=CC=C31)OC(=O)C4=CC(=NC=C4)Cl

Isomeric SMILES

CC(C(=O)N1C2=C(CCCC2)C3=CC=CC=C31)OC(=O)C4=CC(=NC=C4)Cl

InChI

InChI=1S/C21H19ClN2O3/c1-13(27-21(26)14-10-11-23-19(22)12-14)20(25)24-17-8-4-2-6-15(17)16-7-3-5-9-18(16)24/h2,4,6,8,10-13H,3,5,7,9H2,1H3