4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-3-oxidanyl-N-(phenylmethyl)naphthalene-2-carboxamide

Systemtic Name: 4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-3-oxidanyl-N-(phenylmethyl)naphthalene-2-carboxamide Openeye Name: N-benzyl-3-hydroxy-4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]naphthalene-2-carboxamide CAS Name: 3-hydroxy-4-[[(3S)-3-methyl-1-piperidin-1-iumyl]methyl]-N-(phenylmethyl)-2-naphthalenecarboxamide IUPAC Name: N-benzyl-3-hydroxy-4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]naphthalene-2-carboxamide Traditional Name: N-benzyl-3-hydroxy-4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-2-naphthamide Formula: C25H29N2O2+ MolecularWeight: 389.50996

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC2=C(C(=CC3=CC=CC=C32)C(=O)NCC4=CC=CC=C4)O

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC2=C(C(=CC3=CC=CC=C32)C(=O)NCC4=CC=CC=C4)O

InChI

InChI=1S/C25H28N2O2/c1-18-8-7-13-27(16-18)17-23-21-12-6-5-11-20(21)14-22(24(23)28)25(29)26-15-19-9-3-2-4-10-19/h2-6,9-12,14,18,28H,7-8,13,15-17H2,1H3,(H,26,29)/p+1/t18-/m0/s1