methyl-(naphthalen-2-ylmethyl)-[(2R)-1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl]azanium

Systemtic Name: methyl-(naphthalen-2-ylmethyl)-[(2R)-1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl]azanium Openeye Name: methyl-[(1R)-1-methyl-2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-(2-naphthylmethyl)ammonium CAS Name: methyl-(2-naphthalenylmethyl)-[(2R)-1-oxo-1-(4-phenyl-1-piperazinyl)propan-2-yl]ammonium IUPAC Name: methyl-(naphthalen-2-ylmethyl)-[(2R)-1-oxo-1-(4-phenylpiperazin-1-yl)propan-2-yl]azanium Traditional Name: [(1R)-2-keto-1-methyl-2-(4-phenylpiperazino)ethyl]-methyl-(2-naphthylmethyl)ammonium Formula: C25H30N3O+ MolecularWeight: 388.5252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)[NH+](C)CC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C[C@H](C(=O)N1CCN(CC1)C2=CC=CC=C2)[NH+](C)CC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H29N3O/c1-20(26(2)19-21-12-13-22-8-6-7-9-23(22)18-21)25(29)28-16-14-27(15-17-28)24-10-4-3-5-11-24/h3-13,18,20H,14-17,19H2,1-2H3/p+1/t20-/m1/s1