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

Systemtic Name: [1-oxidanylidene-1-(1,2,3,4-tetrahydrocarbazol-9-yl)propan-2-yl] 2-chloranylpyridine-3-carboxylate Openeye Name: [1-methyl-2-oxo-2-(1,2,3,4-tetrahydrocarbazol-9-yl)ethyl] 2-chloropyridine-3-carboxylate CAS Name: 2-chloro-3-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-3-carboxylate Traditional Name: 2-chloronicotinic 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=C(N=CC=C4)Cl

Isomeric SMILES

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

InChI

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