1-(4-ethylpiperazin-4-ium-1-yl)-3-[(3S,4R)-4-morpholin-4-ium-4-yl-1-(naphthalen-1-ylmethyl)piperidin-1-ium-3-yl]propan-1-one

Systemtic Name: 1-(4-ethylpiperazin-4-ium-1-yl)-3-[(3S,4R)-4-morpholin-4-ium-4-yl-1-(naphthalen-1-ylmethyl)piperidin-1-ium-3-yl]propan-1-one Openeye Name: 1-(4-ethylpiperazin-4-ium-1-yl)-3-[(3S,4R)-4-morpholin-4-ium-4-yl-1-(1-naphthylmethyl)piperidin-1-ium-3-yl]propan-1-one CAS Name: 1-(4-ethyl-1-piperazin-4-iumyl)-3-[(3S,4R)-4-(4-morpholin-4-iumyl)-1-(1-naphthalenylmethyl)-3-piperidin-1-iumyl]-1-propanone IUPAC Name: 1-(4-ethylpiperazin-4-ium-1-yl)-3-[(3S,4R)-4-morpholin-4-ium-4-yl-1-(naphthalen-1-ylmethyl)piperidin-1-ium-3-yl]propan-1-one Traditional Name: 1-(4-ethylpiperazin-4-ium-1-yl)-3-[(3S,4R)-4-morpholin-4-ium-4-yl-1-(1-naphthylmethyl)piperidin-1-ium-3-yl]propan-1-one Formula: C29H45N4O2+3 MolecularWeight: 481.6932

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)CCC2C[NH+](CCC2[NH+]3CCOCC3)CC4=CC=CC5=CC=CC=C54

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)CC[C@H]2C[NH+](CC[C@H]2[NH+]3CCOCC3)CC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C29H42N4O2/c1-2-30-14-16-33(17-15-30)29(34)11-10-26-23-31(13-12-28(26)32-18-20-35-21-19-32)22-25-8-5-7-24-6-3-4-9-27(24)25/h3-9,26,28H,2,10-23H2,1H3/p+3/t26-,28+/m0/s1