(4-methyl-1,4-diazepan-4-ium-1-yl)-[(2R)-1,2,3,4-tetrahydroquinolin-1-ium-2-yl]methanone

Systemtic Name: (4-methyl-1,4-diazepan-4-ium-1-yl)-[(2R)-1,2,3,4-tetrahydroquinolin-1-ium-2-yl]methanone Openeye Name: (4-methyl-1,4-diazepan-4-ium-1-yl)-[(2R)-1,2,3,4-tetrahydroquinolin-1-ium-2-yl]methanone CAS Name: (4-methyl-1,4-diazepan-4-ium-1-yl)-[(2R)-1,2,3,4-tetrahydroquinolin-1-ium-2-yl]methanone IUPAC Name: (4-methyl-1,4-diazepan-4-ium-1-yl)-[(2R)-1,2,3,4-tetrahydroquinolin-1-ium-2-yl]methanone Traditional Name: (4-methyl-1,4-diazepan-4-ium-1-yl)-[(2R)-1,2,3,4-tetrahydroquinolin-1-ium-2-yl]methanone Formula: C16H25N3O+2 MolecularWeight: 275.3892

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCN(CC1)C(=O)C2CCC3=CC=CC=C3[NH2+]2

Isomeric SMILES

C[NH+]1CCCN(CC1)C(=O)[C@H]2CCC3=CC=CC=C3[NH2+]2

InChI

InChI=1S/C16H23N3O/c1-18-9-4-10-19(12-11-18)16(20)15-8-7-13-5-2-3-6-14(13)17-15/h2-3,5-6,15,17H,4,7-12H2,1H3/p+2/t15-/m1/s1