1-adamantylmethyl-[(4R)-1-ethyl-7-oxidanylidene-azepan-4-yl]-methyl-azanium

Systemtic Name: 1-adamantylmethyl-[(4R)-1-ethyl-7-oxidanylidene-azepan-4-yl]-methyl-azanium Openeye Name: 1-adamantylmethyl-[(4R)-1-ethyl-7-oxo-azepan-4-yl]-methyl-ammonium CAS Name: 1-adamantylmethyl-[(4R)-1-ethyl-7-oxo-4-azepanyl]-methylammonium IUPAC Name: 1-adamantylmethyl-[(4R)-1-ethyl-7-oxoazepan-4-yl]-methylazanium Traditional Name: 1-adamantylmethyl-[(4R)-1-ethyl-7-keto-azepan-4-yl]-methyl-ammonium Formula: C20H35N2O+ MolecularWeight: 319.5047

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC(CCC1=O)[NH+](C)CC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCN1CC[C@@H](CCC1=O)[NH+](C)CC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H34N2O/c1-3-22-7-6-18(4-5-19(22)23)21(2)14-20-11-15-8-16(12-20)10-17(9-15)13-20/h15-18H,3-14H2,1-2H3/p+1/t15?,16?,17?,18-,20?/m1/s1