[7-acetyloxy-2-[2-[(E)-diazanylidenemethyl]phenyl]carbonyl-3,4-dihydro-1H-isoquinolin-6-yl] ethanoate

Systemtic Name: [7-acetyloxy-2-[2-[(E)-diazanylidenemethyl]phenyl]carbonyl-3,4-dihydro-1H-isoquinolin-6-yl] ethanoate Openeye Name: [7-acetoxy-2-[2-[(E)-hydrazinylidenemethyl]benzoyl]-3,4-dihydro-1H-isoquinolin-6-yl] acetate CAS Name: acetic acid [7-acetyloxy-2-[[2-[(E)-hydrazinylidenemethyl]phenyl]-oxomethyl]-3,4-dihydro-1H-isoquinolin-6-yl] ester IUPAC Name: [7-acetyloxy-2-[2-[(E)-hydrazinylidenemethyl]benzoyl]-3,4-dihydro-1H-isoquinolin-6-yl] acetate Traditional Name: acetic acid [7-acetoxy-2-[2-[(E)-hydrazonomethyl]benzoyl]-3,4-dihydro-1H-isoquinolin-6-yl] ester Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C2CN(CCC2=C1)C(=O)C3=CC=CC=C3C=NN)OC(=O)C

Isomeric SMILES

CC(=O)OC1=C(C=C2CN(CCC2=C1)C(=O)C3=CC=CC=C3/C=N/N)OC(=O)C

InChI

InChI=1S/C21H21N3O5/c1-13(25)28-19-9-15-7-8-24(12-17(15)10-20(19)29-14(2)26)21(27)18-6-4-3-5-16(18)11-23-22/h3-6,9-11H,7-8,12,22H2,1-2H3/b23-11+