methyl-[[5-methyl-2-(3-phenoxyphenyl)-1,3-oxazol-4-yl]methyl]-(quinoxalin-6-ylmethyl)azanium

Systemtic Name: methyl-[[5-methyl-2-(3-phenoxyphenyl)-1,3-oxazol-4-yl]methyl]-(quinoxalin-6-ylmethyl)azanium Openeye Name: methyl-[[5-methyl-2-(3-phenoxyphenyl)oxazol-4-yl]methyl]-(quinoxalin-6-ylmethyl)ammonium CAS Name: methyl-[[5-methyl-2-(3-phenoxyphenyl)-4-oxazolyl]methyl]-(6-quinoxalinylmethyl)ammonium IUPAC Name: methyl-[[5-methyl-2-(3-phenoxyphenyl)-1,3-oxazol-4-yl]methyl]-(quinoxalin-6-ylmethyl)azanium Traditional Name: methyl-[[5-methyl-2-(3-phenoxyphenyl)oxazol-4-yl]methyl]-(quinoxalin-6-ylmethyl)ammonium Formula: C27H25N4O2+ MolecularWeight: 437.513

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC(=CC=C2)OC3=CC=CC=C3)C[NH+](C)CC4=CC5=NC=CN=C5C=C4

Isomeric SMILES

CC1=C(N=C(O1)C2=CC(=CC=C2)OC3=CC=CC=C3)C[NH+](C)CC4=CC5=NC=CN=C5C=C4

InChI

InChI=1S/C27H24N4O2/c1-19-26(18-31(2)17-20-11-12-24-25(15-20)29-14-13-28-24)30-27(32-19)21-7-6-10-23(16-21)33-22-8-4-3-5-9-22/h3-16H,17-18H2,1-2H3/p+1