2-hydroxyethyl-methyl-[(4R)-1-(naphthalen-2-ylmethyl)-7-oxidanylidene-azepan-4-yl]azanium

Systemtic Name: 2-hydroxyethyl-methyl-[(4R)-1-(naphthalen-2-ylmethyl)-7-oxidanylidene-azepan-4-yl]azanium Openeye Name: 2-hydroxyethyl-methyl-[(4R)-1-(2-naphthylmethyl)-7-oxo-azepan-4-yl]ammonium CAS Name: 2-hydroxyethyl-methyl-[(4R)-1-(2-naphthalenylmethyl)-7-oxo-4-azepanyl]ammonium IUPAC Name: 2-hydroxyethyl-methyl-[(4R)-1-(naphthalen-2-ylmethyl)-7-oxoazepan-4-yl]azanium Traditional Name: 2-hydroxyethyl-[(4R)-7-keto-1-(2-naphthylmethyl)azepan-4-yl]-methyl-ammonium Formula: C20H27N2O2+ MolecularWeight: 327.44058

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCO)C1CCC(=O)N(CC1)CC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

C[NH+](CCO)[C@@H]1CCC(=O)N(CC1)CC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C20H26N2O2/c1-21(12-13-23)19-8-9-20(24)22(11-10-19)15-16-6-7-17-4-2-3-5-18(17)14-16/h2-7,14,19,23H,8-13,15H2,1H3/p+1/t19-/m1/s1