[1-[(3-ethoxy-2-oxidanyl-phenyl)methyl]piperidin-1-ium-4-yl]-(4-methylpiperidin-1-yl)methanone

Systemtic Name: [1-[(3-ethoxy-2-oxidanyl-phenyl)methyl]piperidin-1-ium-4-yl]-(4-methylpiperidin-1-yl)methanone Openeye Name: [1-[(3-ethoxy-2-hydroxy-phenyl)methyl]piperidin-1-ium-4-yl]-(4-methyl-1-piperidyl)methanone CAS Name: [1-[(3-ethoxy-2-hydroxyphenyl)methyl]-4-piperidin-1-iumyl]-(4-methyl-1-piperidinyl)methanone IUPAC Name: [1-[(3-ethoxy-2-hydroxyphenyl)methyl]piperidin-1-ium-4-yl]-(4-methylpiperidin-1-yl)methanone Traditional Name: [1-(3-ethoxy-2-hydroxy-benzyl)piperidin-1-ium-4-yl]-(4-methylpiperidino)methanone Formula: C21H33N2O3+ MolecularWeight: 361.49832

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1O)C[NH+]2CCC(CC2)C(=O)N3CCC(CC3)C

Isomeric SMILES

CCOC1=CC=CC(=C1O)C[NH+]2CCC(CC2)C(=O)N3CCC(CC3)C

InChI

InChI=1S/C21H32N2O3/c1-3-26-19-6-4-5-18(20(19)24)15-22-11-9-17(10-12-22)21(25)23-13-7-16(2)8-14-23/h4-6,16-17,24H,3,7-15H2,1-2H3/p+1