(2-acetamido-1,3-thiazol-4-yl)methyl 7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxylate

Systemtic Name: (2-acetamido-1,3-thiazol-4-yl)methyl 7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxylate Openeye Name: (2-acetamidothiazol-4-yl)methyl 7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxylate CAS Name: 7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxylic acid (2-acetamido-4-thiazolyl)methyl ester IUPAC Name: (2-acetamido-1,3-thiazol-4-yl)methyl 7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxylate Traditional Name: 7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxylic acid (2-acetamidothiazol-4-yl)methyl ester Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=CS1)COC(=O)C2=C3CCCCCC3=NC4=CC=CC=C42

Isomeric SMILES

CC(=O)NC1=NC(=CS1)COC(=O)C2=C3CCCCCC3=NC4=CC=CC=C42

InChI

InChI=1S/C21H21N3O3S/c1-13(25)22-21-23-14(12-28-21)11-27-20(26)19-15-7-3-2-4-9-17(15)24-18-10-6-5-8-16(18)19/h5-6,8,10,12H,2-4,7,9,11H2,1H3,(H,22,23,25)