(2R)-2-(naphthalen-2-ylamino)-1-[4-(phenylmethyl)piperazin-4-ium-1-yl]propan-1-one

Systemtic Name: (2R)-2-(naphthalen-2-ylamino)-1-[4-(phenylmethyl)piperazin-4-ium-1-yl]propan-1-one Openeye Name: (2R)-1-(4-benzylpiperazin-4-ium-1-yl)-2-(2-naphthylamino)propan-1-one CAS Name: (2R)-2-(2-naphthalenylamino)-1-[4-(phenylmethyl)-1-piperazin-4-iumyl]-1-propanone IUPAC Name: (2R)-1-(4-benzylpiperazin-4-ium-1-yl)-2-(naphthalen-2-ylamino)propan-1-one Traditional Name: (2R)-1-(4-benzylpiperazin-4-ium-1-yl)-2-(2-naphthylamino)propan-1-one Formula: C24H28N3O+ MolecularWeight: 374.49862

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CC[NH+](CC1)CC2=CC=CC=C2)NC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C[C@H](C(=O)N1CC[NH+](CC1)CC2=CC=CC=C2)NC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C24H27N3O/c1-19(25-23-12-11-21-9-5-6-10-22(21)17-23)24(28)27-15-13-26(14-16-27)18-20-7-3-2-4-8-20/h2-12,17,19,25H,13-16,18H2,1H3/p+1/t19-/m1/s1