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

Systemtic Name: [1-[(3-methoxy-2-oxidanyl-phenyl)methyl]piperidin-1-ium-4-yl]-piperidin-1-yl-methanone Openeye Name: [1-[(2-hydroxy-3-methoxy-phenyl)methyl]piperidin-1-ium-4-yl]-(1-piperidyl)methanone CAS Name: [1-[(2-hydroxy-3-methoxyphenyl)methyl]-4-piperidin-1-iumyl]-(1-piperidinyl)methanone IUPAC Name: [1-[(2-hydroxy-3-methoxyphenyl)methyl]piperidin-1-ium-4-yl]-piperidin-1-ylmethanone Traditional Name: [1-(2-hydroxy-3-methoxy-benzyl)piperidin-1-ium-4-yl]-piperidino-methanone Formula: C19H29N2O3+ MolecularWeight: 333.44516

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1O)C[NH+]2CCC(CC2)C(=O)N3CCCCC3

Isomeric SMILES

COC1=CC=CC(=C1O)C[NH+]2CCC(CC2)C(=O)N3CCCCC3

InChI

InChI=1S/C19H28N2O3/c1-24-17-7-5-6-16(18(17)22)14-20-12-8-15(9-13-20)19(23)21-10-3-2-4-11-21/h5-7,15,22H,2-4,8-14H2,1H3/p+1