[(E)-7,8-dihydro-6H-isoquinolin-5-ylideneamino] 4-methylbenzenesulfonate

Systemtic Name: [(E)-7,8-dihydro-6H-isoquinolin-5-ylideneamino] 4-methylbenzenesulfonate Openeye Name: [(E)-7,8-dihydro-6H-isoquinolin-5-ylideneamino] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(E)-7,8-dihydro-6H-isoquinolin-5-ylideneamino] ester IUPAC Name: [(E)-7,8-dihydro-6H-isoquinolin-5-ylideneamino] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(E)-7,8-dihydro-6H-isoquinolin-5-ylideneamino] ester Formula: C16H16N2O3S MolecularWeight: 316.37484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)ON=C2CCCC3=C2C=CN=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O/N=C/2\CCCC3=C2C=CN=C3

InChI

InChI=1S/C16H16N2O3S/c1-12-5-7-14(8-6-12)22(19,20)21-18-16-4-2-3-13-11-17-10-9-15(13)16/h5-11H,2-4H2,1H3/b18-16+