(2-chloranyl-5-methoxy-4-oxidanyl-phenyl)methyl-[(3R)-8-methoxy-3,4-dihydro-2H-chromen-3-yl]azanium

Systemtic Name: (2-chloranyl-5-methoxy-4-oxidanyl-phenyl)methyl-[(3R)-8-methoxy-3,4-dihydro-2H-chromen-3-yl]azanium Openeye Name: (2-chloro-4-hydroxy-5-methoxy-phenyl)methyl-[(3R)-8-methoxychroman-3-yl]ammonium CAS Name: (2-chloro-4-hydroxy-5-methoxyphenyl)methyl-[(3R)-8-methoxy-3,4-dihydro-2H-1-benzopyran-3-yl]ammonium IUPAC Name: (2-chloro-4-hydroxy-5-methoxyphenyl)methyl-[(3R)-8-methoxy-3,4-dihydro-2H-chromen-3-yl]azanium Traditional Name: (2-chloro-4-hydroxy-5-methoxy-benzyl)-[(3R)-8-methoxychroman-3-yl]ammonium Formula: C18H21ClNO4+ MolecularWeight: 350.81664

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OCC(C2)[NH2+]CC3=CC(=C(C=C3Cl)O)OC

Isomeric SMILES

COC1=CC=CC2=C1OC[C@@H](C2)[NH2+]CC3=CC(=C(C=C3Cl)O)OC

InChI

InChI=1S/C18H20ClNO4/c1-22-16-5-3-4-11-6-13(10-24-18(11)16)20-9-12-7-17(23-2)15(21)8-14(12)19/h3-5,7-8,13,20-21H,6,9-10H2,1-2H3/p+1/t13-/m1/s1