N-[[3-(4-dimethylaminophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]-4-methyl-N-(phenylmethyl)benzamide

Systemtic Name: N-[[3-(4-dimethylaminophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]-4-methyl-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-N-[[3-(4-dimethylaminophenyl)-4,5-dihydroisoxazol-5-yl]methyl]-4-methyl-benzamide CAS Name: N-[[3-(4-dimethylaminophenyl)-4,5-dihydroisoxazol-5-yl]methyl]-4-methyl-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-N-[[3-(4-dimethylaminophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]-4-methylbenzamide Traditional Name: N-benzyl-N-[[3-(4-dimethylaminophenyl)-2-isoxazolin-5-yl]methyl]-4-methyl-benzamide Formula: C27H29N3O2 MolecularWeight: 427.53806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N(CC2CC(=NO2)C3=CC=C(C=C3)N(C)C)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N(CC2CC(=NO2)C3=CC=C(C=C3)N(C)C)CC4=CC=CC=C4

InChI

InChI=1S/C27H29N3O2/c1-20-9-11-23(12-10-20)27(31)30(18-21-7-5-4-6-8-21)19-25-17-26(28-32-25)22-13-15-24(16-14-22)29(2)3/h4-16,25H,17-19H2,1-3H3