1-[(2R)-2,6-dimethylhept-5-enyl]-4-(2-methoxyethyl)-1,4-diazepan-1-ium-5-one

Systemtic Name: 1-[(2R)-2,6-dimethylhept-5-enyl]-4-(2-methoxyethyl)-1,4-diazepan-1-ium-5-one Openeye Name: 1-[(2R)-2,6-dimethylhept-5-enyl]-4-(2-methoxyethyl)-1,4-diazepan-1-ium-5-one CAS Name: 1-[(2R)-2,6-dimethylhept-5-enyl]-4-(2-methoxyethyl)-1,4-diazepan-1-ium-5-one IUPAC Name: 1-[(2R)-2,6-dimethylhept-5-enyl]-4-(2-methoxyethyl)-1,4-diazepan-1-ium-5-one Traditional Name: 1-[(2R)-2,6-dimethylhept-5-enyl]-4-(2-methoxyethyl)-1,4-diazepan-1-ium-5-one Formula: C17H33N2O2+ MolecularWeight: 297.45612

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC=C(C)C)C[NH+]1CCC(=O)N(CC1)CCOC

Isomeric SMILES

C[C@H](CCC=C(C)C)C[NH+]1CCC(=O)N(CC1)CCOC

InChI

InChI=1S/C17H32N2O2/c1-15(2)6-5-7-16(3)14-18-9-8-17(20)19(11-10-18)12-13-21-4/h6,16H,5,7-14H2,1-4H3/p+1/t16-/m1/s1