2-methoxy-4-[(quinolin-1-ium-5-ylamino)methyl]phenol

Systemtic Name: 2-methoxy-4-[(quinolin-1-ium-5-ylamino)methyl]phenol Openeye Name: 2-methoxy-4-[(quinolin-1-ium-5-ylamino)methyl]phenol CAS Name: 2-methoxy-4-[(5-quinolin-1-iumylamino)methyl]phenol IUPAC Name: 2-methoxy-4-[(quinolin-1-ium-5-ylamino)methyl]phenol Traditional Name: 2-methoxy-4-[(quinolin-1-ium-5-ylamino)methyl]phenol Formula: C17H17N2O2+ MolecularWeight: 281.32908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC2=CC=CC3=C2C=CC=[NH+]3)O

Isomeric SMILES

COC1=C(C=CC(=C1)CNC2=CC=CC3=C2C=CC=[NH+]3)O

InChI

InChI=1S/C17H16N2O2/c1-21-17-10-12(7-8-16(17)20)11-19-15-6-2-5-14-13(15)4-3-9-18-14/h2-10,19-20H,11H2,1H3/p+1