N-[[3-(aminomethyl)phenyl]methyl]-3-(5-tert-butyl-1,3-benzoxazol-2-yl)propanamide

Systemtic Name: N-[[3-(aminomethyl)phenyl]methyl]-3-(5-tert-butyl-1,3-benzoxazol-2-yl)propanamide Openeye Name: N-[[3-(aminomethyl)phenyl]methyl]-3-(5-tert-butyl-1,3-benzoxazol-2-yl)propanamide CAS Name: N-[[3-(aminomethyl)phenyl]methyl]-3-(5-tert-butyl-1,3-benzoxazol-2-yl)propanamide IUPAC Name: N-[[3-(aminomethyl)phenyl]methyl]-3-(5-tert-butyl-1,3-benzoxazol-2-yl)propanamide Traditional Name: N-[3-(aminomethyl)benzyl]-3-(5-tert-butyl-1,3-benzoxazol-2-yl)propionamide Formula: C22H27N3O2 MolecularWeight: 365.46868

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)OC(=N2)CCC(=O)NCC3=CC=CC(=C3)CN

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)OC(=N2)CCC(=O)NCC3=CC=CC(=C3)CN

InChI

InChI=1S/C22H27N3O2/c1-22(2,3)17-7-8-19-18(12-17)25-21(27-19)10-9-20(26)24-14-16-6-4-5-15(11-16)13-23/h4-8,11-12H,9-10,13-14,23H2,1-3H3,(H,24,26)