4-azanyl-2-oxidanyl-benzoate; N,N-dimethyl-3-phenyl-3-pyridin-2-yl-propan-1-amine

Systemtic Name: 4-azanyl-2-oxidanyl-benzoate; N,N-dimethyl-3-phenyl-3-pyridin-2-yl-propan-1-amine Openeye Name: 4-amino-2-hydroxy-benzoate; N,N-dimethyl-3-phenyl-3-(2-pyridyl)propan-1-amine CAS Name: 4-amino-2-hydroxybenzoate; N,N-dimethyl-3-phenyl-3-(2-pyridinyl)-1-propanamine IUPAC Name: 4-amino-2-hydroxybenzoate; N,N-dimethyl-3-phenyl-3-pyridin-2-ylpropan-1-amine Traditional Name: 4-amino-2-hydroxy-benzoate; dimethyl-[3-phenyl-3-(2-pyridyl)propyl]amine Formula: C23H26N3O3- MolecularWeight: 392.47084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC(C1=CC=CC=C1)C2=CC=CC=N2.C1=CC(=C(C=C1N)O)C(=O)[O-]

Isomeric SMILES

CN(C)CCC(C1=CC=CC=C1)C2=CC=CC=N2.C1=CC(=C(C=C1N)O)C(=O)[O-]

InChI

InChI=1S/C16H20N2.C7H7NO3/c1-18(2)13-11-15(14-8-4-3-5-9-14)16-10-6-7-12-17-16;8-4-1-2-5(7(10)11)6(9)3-4/h3-10,12,15H,11,13H2,1-2H3;1-3,9H,8H2,(H,10,11)/p-1