azepan-1-yl-[(3R)-1-(1H-indol-3-ylmethyl)piperidin-1-ium-3-yl]methanone

Systemtic Name: azepan-1-yl-[(3R)-1-(1H-indol-3-ylmethyl)piperidin-1-ium-3-yl]methanone Openeye Name: azepan-1-yl-[(3R)-1-(1H-indol-3-ylmethyl)piperidin-1-ium-3-yl]methanone CAS Name: 1-azepanyl-[(3R)-1-(1H-indol-3-ylmethyl)-3-piperidin-1-iumyl]methanone IUPAC Name: azepan-1-yl-[(3R)-1-(1H-indol-3-ylmethyl)piperidin-1-ium-3-yl]methanone Traditional Name: azepan-1-yl-[(3R)-1-(1H-indol-3-ylmethyl)piperidin-1-ium-3-yl]methanone Formula: C21H30N3O+ MolecularWeight: 340.4824

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCC[NH+](C2)CC3=CNC4=CC=CC=C43

Isomeric SMILES

C1CCCN(CC1)C(=O)[C@@H]2CCC[NH+](C2)CC3=CNC4=CC=CC=C43

InChI

InChI=1S/C21H29N3O/c25-21(24-12-5-1-2-6-13-24)17-8-7-11-23(15-17)16-18-14-22-20-10-4-3-9-19(18)20/h3-4,9-10,14,17,22H,1-2,5-8,11-13,15-16H2/p+1/t17-/m1/s1