tert-butyl 8-chloranyl-3-oxidanylidene-4a,5,6,10b-tetrahydrobenzo[f]quinoline-4-carboxylate

Systemtic Name: tert-butyl 8-chloranyl-3-oxidanylidene-4a,5,6,10b-tetrahydrobenzo[f]quinoline-4-carboxylate Openeye Name: tert-butyl 8-chloro-3-oxo-4a,5,6,10b-tetrahydrobenzo[f]quinoline-4-carboxylate CAS Name: 8-chloro-3-oxo-4a,5,6,10b-tetrahydrobenzo[f]quinoline-4-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 8-chloro-3-oxo-4a,5,6,10b-tetrahydrobenzo[f]quinoline-4-carboxylate Traditional Name: 8-chloro-3-keto-4a,5,6,10b-tetrahydrobenzo[f]quinoline-4-carboxylic acid tert-butyl ester Formula: C18H20ClNO3 MolecularWeight: 333.8093

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2CCC3=C(C2C=CC1=O)C=CC(=C3)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1C2CCC3=C(C2C=CC1=O)C=CC(=C3)Cl

InChI

InChI=1S/C18H20ClNO3/c1-18(2,3)23-17(22)20-15-8-4-11-10-12(19)5-6-13(11)14(15)7-9-16(20)21/h5-7,9-10,14-15H,4,8H2,1-3H3