[2-(cyclooctylamino)-2-oxidanylidene-ethyl] 3-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate

Systemtic Name: [2-(cyclooctylamino)-2-oxidanylidene-ethyl] 3-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate Openeye Name: [2-(cyclooctylamino)-2-oxo-ethyl] 3-[(2-methylthiazol-4-yl)methoxy]benzoate CAS Name: 3-[(2-methyl-4-thiazolyl)methoxy]benzoic acid [2-(cyclooctylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclooctylamino)-2-oxoethyl] 3-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate Traditional Name: 3-[(2-methylthiazol-4-yl)methoxy]benzoic acid [2-(cyclooctylamino)-2-keto-ethyl] ester Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)COC2=CC=CC(=C2)C(=O)OCC(=O)NC3CCCCCCC3

Isomeric SMILES

CC1=NC(=CS1)COC2=CC=CC(=C2)C(=O)OCC(=O)NC3CCCCCCC3

InChI

InChI=1S/C22H28N2O4S/c1-16-23-19(15-29-16)13-27-20-11-7-8-17(12-20)22(26)28-14-21(25)24-18-9-5-3-2-4-6-10-18/h7-8,11-12,15,18H,2-6,9-10,13-14H2,1H3,(H,24,25)