[6-(4-methyl-1,4-diazepan-4-ium-1-yl)pyridin-3-yl]-[(4R)-4-phenylazepan-1-yl]methanone

Systemtic Name: [6-(4-methyl-1,4-diazepan-4-ium-1-yl)pyridin-3-yl]-[(4R)-4-phenylazepan-1-yl]methanone Openeye Name: [6-(4-methyl-1,4-diazepan-4-ium-1-yl)-3-pyridyl]-[(4R)-4-phenylazepan-1-yl]methanone CAS Name: [6-(4-methyl-1,4-diazepan-4-ium-1-yl)-3-pyridinyl]-[(4R)-4-phenyl-1-azepanyl]methanone IUPAC Name: [6-(4-methyl-1,4-diazepan-4-ium-1-yl)pyridin-3-yl]-[(4R)-4-phenylazepan-1-yl]methanone Traditional Name: [6-(4-methyl-1,4-diazepan-4-ium-1-yl)-3-pyridyl]-[(4R)-4-phenylazepan-1-yl]methanone Formula: C24H33N4O+ MolecularWeight: 393.54502

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCN(CC1)C2=NC=C(C=C2)C(=O)N3CCCC(CC3)C4=CC=CC=C4

Isomeric SMILES

C[NH+]1CCCN(CC1)C2=NC=C(C=C2)C(=O)N3CCC[C@H](CC3)C4=CC=CC=C4

InChI

InChI=1S/C24H32N4O/c1-26-13-6-15-27(18-17-26)23-11-10-22(19-25-23)24(29)28-14-5-9-21(12-16-28)20-7-3-2-4-8-20/h2-4,7-8,10-11,19,21H,5-6,9,12-18H2,1H3/p+1/t21-/m1/s1