N-tert-butyl-2-[4-[(7-methoxy-2-oxidanyl-naphthalen-1-yl)methyl]piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[4-[(7-methoxy-2-oxidanyl-naphthalen-1-yl)methyl]piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-tert-butyl-2-[4-[(2-hydroxy-7-methoxy-1-naphthyl)methyl]piperazine-1,4-diium-1-yl]acetamide CAS Name: N-tert-butyl-2-[4-[(2-hydroxy-7-methoxy-1-naphthalenyl)methyl]-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-tert-butyl-2-[4-[(2-hydroxy-7-methoxynaphthalen-1-yl)methyl]piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-tert-butyl-2-[4-[(2-hydroxy-7-methoxy-1-naphthyl)methyl]piperazine-1,4-diium-1-yl]acetamide Formula: C22H33N3O3+2 MolecularWeight: 387.51572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C[NH+]1CC[NH+](CC1)CC2=C(C=CC3=C2C=C(C=C3)OC)O

Isomeric SMILES

CC(C)(C)NC(=O)C[NH+]1CC[NH+](CC1)CC2=C(C=CC3=C2C=C(C=C3)OC)O

InChI

InChI=1S/C22H31N3O3/c1-22(2,3)23-21(27)15-25-11-9-24(10-12-25)14-19-18-13-17(28-4)7-5-16(18)6-8-20(19)26/h5-8,13,26H,9-12,14-15H2,1-4H3,(H,23,27)/p+2