(E)-3-[2-(4-dimethylaminophenyl)carbonyl-3,4-dihydro-1H-isoquinolin-6-yl]-N-oxidanyl-prop-2-enamide

Systemtic Name: (E)-3-[2-(4-dimethylaminophenyl)carbonyl-3,4-dihydro-1H-isoquinolin-6-yl]-N-oxidanyl-prop-2-enamide Openeye Name: (E)-3-[2-[4-(dimethylamino)benzoyl]-3,4-dihydro-1H-isoquinolin-6-yl]prop-2-enehydroxamic acid CAS Name: (E)-3-[2-[(4-dimethylaminophenyl)-oxomethyl]-3,4-dihydro-1H-isoquinolin-6-yl]-N-hydroxy-2-propenamide IUPAC Name: (E)-3-[2-[4-(dimethylamino)benzoyl]-3,4-dihydro-1H-isoquinolin-6-yl]-N-hydroxyprop-2-enamide Traditional Name: (E)-3-[2-[4-(dimethylamino)benzoyl]-3,4-dihydro-1H-isoquinolin-6-yl]prop-2-enehydroxamic acid Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(=O)N2CCC3=C(C2)C=CC(=C3)C=CC(=O)NO

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(=O)N2CCC3=C(C2)C=CC(=C3)/C=C/C(=O)NO

InChI

InChI=1S/C21H23N3O3/c1-23(2)19-8-6-16(7-9-19)21(26)24-12-11-17-13-15(3-5-18(17)14-24)4-10-20(25)22-27/h3-10,13,27H,11-12,14H2,1-2H3,(H,22,25)/b10-4+