(2H-chromen-4-ylamino) 4-methylbenzenesulfonate

Systemtic Name: (2H-chromen-4-ylamino) 4-methylbenzenesulfonate Openeye Name: (2H-chromen-4-ylamino) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (2H-1-benzopyran-4-ylamino) ester IUPAC Name: (2H-chromen-4-ylamino) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2H-chromen-4-ylamino) ester Formula: C16H15NO4S MolecularWeight: 317.3596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)ONC2=CCOC3=CC=CC=C23

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)ONC2=CCOC3=CC=CC=C23

InChI

InChI=1S/C16H15NO4S/c1-12-6-8-13(9-7-12)22(18,19)21-17-15-10-11-20-16-5-3-2-4-14(15)16/h2-10,17H,11H2,1H3