2-[(S)-(3,4-dimethoxyphenyl)-(4-methylpiperazin-4-ium-1-yl)methyl]-5-methoxy-naphthalen-1-ol

Systemtic Name: 2-[(S)-(3,4-dimethoxyphenyl)-(4-methylpiperazin-4-ium-1-yl)methyl]-5-methoxy-naphthalen-1-ol Openeye Name: 2-[(S)-(3,4-dimethoxyphenyl)-(4-methylpiperazin-4-ium-1-yl)methyl]-5-methoxy-naphthalen-1-ol CAS Name: 2-[(S)-(3,4-dimethoxyphenyl)-(4-methyl-1-piperazin-4-iumyl)methyl]-5-methoxy-1-naphthalenol IUPAC Name: 2-[(S)-(3,4-dimethoxyphenyl)-(4-methylpiperazin-4-ium-1-yl)methyl]-5-methoxynaphthalen-1-ol Traditional Name: 2-[(S)-(3,4-dimethoxyphenyl)-(4-methylpiperazin-4-ium-1-yl)methyl]-5-methoxy-1-naphthol Formula: C25H31N2O4+ MolecularWeight: 423.52464

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(C2=CC(=C(C=C2)OC)OC)C3=C(C4=C(C=C3)C(=CC=C4)OC)O

Isomeric SMILES

C[NH+]1CCN(CC1)[C@@H](C2=CC(=C(C=C2)OC)OC)C3=C(C4=C(C=C3)C(=CC=C4)OC)O

InChI

InChI=1S/C25H30N2O4/c1-26-12-14-27(15-13-26)24(17-8-11-22(30-3)23(16-17)31-4)20-10-9-18-19(25(20)28)6-5-7-21(18)29-2/h5-11,16,24,28H,12-15H2,1-4H3/p+1/t24-/m0/s1