(3S)-N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-6-chloranyl-3,4-dihydro-2H-chromene-3-carboxamide

Systemtic Name: (3S)-N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-6-chloranyl-3,4-dihydro-2H-chromene-3-carboxamide Openeye Name: (3S)-N-[2-(tert-butylamino)-2-oxo-ethyl]-6-chloro-chromane-3-carboxamide CAS Name: (3S)-N-[2-(tert-butylamino)-2-oxoethyl]-6-chloro-3,4-dihydro-2H-1-benzopyran-3-carboxamide IUPAC Name: (3S)-N-[2-(tert-butylamino)-2-oxoethyl]-6-chloro-3,4-dihydro-2H-chromene-3-carboxamide Traditional Name: (3S)-N-[2-(tert-butylamino)-2-keto-ethyl]-6-chloro-chroman-3-carboxamide Formula: C16H21ClN2O3 MolecularWeight: 324.80254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CNC(=O)C1CC2=C(C=CC(=C2)Cl)OC1

Isomeric SMILES

CC(C)(C)NC(=O)CNC(=O)[C@H]1CC2=C(C=CC(=C2)Cl)OC1

InChI

InChI=1S/C16H21ClN2O3/c1-16(2,3)19-14(20)8-18-15(21)11-6-10-7-12(17)4-5-13(10)22-9-11/h4-5,7,11H,6,8-9H2,1-3H3,(H,18,21)(H,19,20)/t11-/m0/s1