[4-chloranyl-2-[(propan-2-ylamino)methyl]phenyl] methanesulfonate

Systemtic Name: [4-chloranyl-2-[(propan-2-ylamino)methyl]phenyl] methanesulfonate Openeye Name: [4-chloro-2-[(isopropylamino)methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-chloro-2-[(propan-2-ylamino)methyl]phenyl] ester IUPAC Name: [4-chloro-2-[(propan-2-ylamino)methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-chloro-2-[(isopropylamino)methyl]phenyl] ester Formula: C11H16ClNO3S MolecularWeight: 277.76764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC1=C(C=CC(=C1)Cl)OS(=O)(=O)C

Isomeric SMILES

CC(C)NCC1=C(C=CC(=C1)Cl)OS(=O)(=O)C

InChI

InChI=1S/C11H16ClNO3S/c1-8(2)13-7-9-6-10(12)4-5-11(9)16-17(3,14)15/h4-6,8,13H,7H2,1-3H3