ethyl 8-[5-(bromomethyl)thiophen-2-yl]-1-cyclopropyl-9-methoxy-4-oxidanylidene-quinolizine-3-carboxylate

Systemtic Name: ethyl 8-[5-(bromomethyl)thiophen-2-yl]-1-cyclopropyl-9-methoxy-4-oxidanylidene-quinolizine-3-carboxylate Openeye Name: ethyl 8-[5-(bromomethyl)-2-thienyl]-1-cyclopropyl-9-methoxy-4-oxo-quinolizine-3-carboxylate CAS Name: 8-[5-(bromomethyl)-2-thiophenyl]-1-cyclopropyl-9-methoxy-4-oxo-3-quinolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 8-[5-(bromomethyl)thiophen-2-yl]-1-cyclopropyl-9-methoxy-4-oxoquinolizine-3-carboxylate Traditional Name: 8-[5-(bromomethyl)-2-thienyl]-1-cyclopropyl-4-keto-9-methoxy-quinolizine-3-carboxylic acid ethyl ester Formula: C21H20BrNO4S MolecularWeight: 462.3568

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C2C(=C(C=CN2C1=O)C3=CC=C(S3)CBr)OC)C4CC4

Isomeric SMILES

CCOC(=O)C1=CC(=C2C(=C(C=CN2C1=O)C3=CC=C(S3)CBr)OC)C4CC4

InChI

InChI=1S/C21H20BrNO4S/c1-3-27-21(25)16-10-15(12-4-5-12)18-19(26-2)14(8-9-23(18)20(16)24)17-7-6-13(11-22)28-17/h6-10,12H,3-5,11H2,1-2H3