2-azanyl-N-[(3S,4S)-3-[bis(chloranyl)methyl]-3-methyl-8-oxidanyl-1-oxidanylidene-4H-isochromen-4-yl]propanamide

Systemtic Name: 2-azanyl-N-[(3S,4S)-3-[bis(chloranyl)methyl]-3-methyl-8-oxidanyl-1-oxidanylidene-4H-isochromen-4-yl]propanamide Openeye Name: 2-amino-N-[(3S,4S)-3-(dichloromethyl)-8-hydroxy-3-methyl-1-oxo-isochroman-4-yl]propanamide CAS Name: 2-amino-N-[(3S,4S)-3-(dichloromethyl)-8-hydroxy-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-4-yl]propanamide IUPAC Name: 2-amino-N-[(3S,4S)-3-(dichloromethyl)-8-hydroxy-3-methyl-1-oxo-4H-isochromen-4-yl]propanamide Traditional Name: 2-amino-N-[(3S,4S)-3-(dichloromethyl)-8-hydroxy-1-keto-3-methyl-isochroman-4-yl]propionamide Formula: C14H16Cl2N2O4 MolecularWeight: 347.19384

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1C2=C(C(=CC=C2)O)C(=O)OC1(C)C(Cl)Cl)N

Isomeric SMILES

CC(C(=O)N[C@H]1C2=C(C(=CC=C2)O)C(=O)O[C@]1(C)C(Cl)Cl)N

InChI

InChI=1S/C14H16Cl2N2O4/c1-6(17)11(20)18-10-7-4-3-5-8(19)9(7)12(21)22-14(10,2)13(15)16/h3-6,10,13,19H,17H2,1-2H3,(H,18,20)/t6?,10-,14-/m0/s1