7-[(3-chlorophenyl)methoxy]-4-(methylaminomethyl)chromen-2-one; methanesulfonic acid

Systemtic Name: 7-[(3-chlorophenyl)methoxy]-4-(methylaminomethyl)chromen-2-one; methanesulfonic acid Openeye Name: 7-[(3-chlorophenyl)methoxy]-4-(methylaminomethyl)chromen-2-one; methanesulfonic acid CAS Name: 7-[(3-chlorophenyl)methoxy]-4-(methylaminomethyl)-1-benzopyran-2-one; methanesulfonic acid IUPAC Name: 7-[(3-chlorophenyl)methoxy]-4-(methylaminomethyl)chromen-2-one; methanesulfonic acid Traditional Name: 7-(3-chlorobenzyl)oxy-4-(methylaminomethyl)coumarin; mesylic acid Formula: C19H20ClNO6S MolecularWeight: 425.8832

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1=CC(=O)OC2=C1C=CC(=C2)OCC3=CC(=CC=C3)Cl.CS(=O)(=O)O

Isomeric SMILES

CNCC1=CC(=O)OC2=C1C=CC(=C2)OCC3=CC(=CC=C3)Cl.CS(=O)(=O)O

InChI

InChI=1S/C18H16ClNO3.CH4O3S/c1-20-10-13-8-18(21)23-17-9-15(5-6-16(13)17)22-11-12-3-2-4-14(19)7-12;1-5(2,3)4/h2-9,20H,10-11H2,1H3;1H3,(H,2,3,4)