(3-methoxyphenyl)-[4-[(5-methyl-2-naphthalen-2-yl-1,3-oxazol-4-yl)methyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: (3-methoxyphenyl)-[4-[(5-methyl-2-naphthalen-2-yl-1,3-oxazol-4-yl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: (3-methoxyphenyl)-[4-[[5-methyl-2-(2-naphthyl)oxazol-4-yl]methyl]piperazin-4-ium-1-yl]methanone CAS Name: (3-methoxyphenyl)-[4-[[5-methyl-2-(2-naphthalenyl)-4-oxazolyl]methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: (3-methoxyphenyl)-[4-[(5-methyl-2-naphthalen-2-yl-1,3-oxazol-4-yl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: (3-methoxyphenyl)-[4-[[5-methyl-2-(2-naphthyl)oxazol-4-yl]methyl]piperazin-4-ium-1-yl]methanone Formula: C27H28N3O3+ MolecularWeight: 442.52952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC3=CC=CC=C3C=C2)C[NH+]4CCN(CC4)C(=O)C5=CC(=CC=C5)OC

Isomeric SMILES

CC1=C(N=C(O1)C2=CC3=CC=CC=C3C=C2)C[NH+]4CCN(CC4)C(=O)C5=CC(=CC=C5)OC

InChI

InChI=1S/C27H27N3O3/c1-19-25(28-26(33-19)22-11-10-20-6-3-4-7-21(20)16-22)18-29-12-14-30(15-13-29)27(31)23-8-5-9-24(17-23)32-2/h3-11,16-17H,12-15,18H2,1-2H3/p+1