(1R)-7-methoxy-1-[(3-methoxy-2-nitro-4-phenylmethoxy-phenyl)methyl]-6-phenylmethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: (1R)-7-methoxy-1-[(3-methoxy-2-nitro-4-phenylmethoxy-phenyl)methyl]-6-phenylmethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: (1R)-6-benzyloxy-1-[(4-benzyloxy-3-methoxy-2-nitro-phenyl)methyl]-7-methoxy-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: (1R)-7-methoxy-1-[(3-methoxy-2-nitro-4-phenylmethoxyphenyl)methyl]-6-phenylmethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: (1R)-7-methoxy-1-[(3-methoxy-2-nitro-4-phenylmethoxyphenyl)methyl]-6-phenylmethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: (1R)-6-benzoxy-1-(4-benzoxy-3-methoxy-2-nitro-benzyl)-7-methoxy-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C32H33N2O6+ MolecularWeight: 541.61422

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CC[NH2+]C(C2=C1)CC3=C(C(=C(C=C3)OCC4=CC=CC=C4)OC)[N+](=O)[O-])OCC5=CC=CC=C5

Isomeric SMILES

COC1=C(C=C2CC[NH2+][C@@H](C2=C1)CC3=C(C(=C(C=C3)OCC4=CC=CC=C4)OC)[N+](=O)[O-])OCC5=CC=CC=C5

InChI

InChI=1S/C32H32N2O6/c1-37-29-19-26-24(18-30(29)40-21-23-11-7-4-8-12-23)15-16-33-27(26)17-25-13-14-28(32(38-2)31(25)34(35)36)39-20-22-9-5-3-6-10-22/h3-14,18-19,27,33H,15-17,20-21H2,1-2H3/p+1/t27-/m1/s1