[2-[(Z)-(3-ethyl-5-phenyl-1,3-benzoxazol-2-ylidene)methyl]-6-methoxy-quinolin-1-ium-1-yl]methanesulfonic acid

Systemtic Name: [2-[(Z)-(3-ethyl-5-phenyl-1,3-benzoxazol-2-ylidene)methyl]-6-methoxy-quinolin-1-ium-1-yl]methanesulfonic acid Openeye Name: [2-[(Z)-(3-ethyl-5-phenyl-1,3-benzoxazol-2-ylidene)methyl]-6-methoxy-quinolin-1-ium-1-yl]methanesulfonic acid CAS Name: [2-[(Z)-(3-ethyl-5-phenyl-1,3-benzoxazol-2-ylidene)methyl]-6-methoxy-1-quinolin-1-iumyl]methanesulfonic acid IUPAC Name: [2-[(Z)-(3-ethyl-5-phenyl-1,3-benzoxazol-2-ylidene)methyl]-6-methoxyquinolin-1-ium-1-yl]methanesulfonic acid Traditional Name: [2-[(Z)-(3-ethyl-5-phenyl-1,3-benzoxazol-2-ylidene)methyl]-6-methoxy-quinolin-1-ium-1-yl]methanesulfonic acid Formula: C27H25N2O5S+ MolecularWeight: 489.5628

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2)C3=CC=CC=C3)OC1=CC4=[N+](C5=C(C=C4)C=C(C=C5)OC)CS(=O)(=O)O

Isomeric SMILES

CCN\1C2=C(C=CC(=C2)C3=CC=CC=C3)O/C1=C\C4=[N+](C5=C(C=C4)C=C(C=C5)OC)CS(=O)(=O)O

InChI

InChI=1S/C27H24N2O5S/c1-3-28-25-16-20(19-7-5-4-6-8-19)10-14-26(25)34-27(28)17-22-11-9-21-15-23(33-2)12-13-24(21)29(22)18-35(30,31)32/h4-17H,3,18H2,1-2H3/p+1