4-(1-azanylethyl)-N3-methyl-N1-pyridin-4-yl-benzene-1,3-dicarboxamide

Systemtic Name: 4-(1-azanylethyl)-N3-methyl-N1-pyridin-4-yl-benzene-1,3-dicarboxamide Openeye Name: 4-(1-aminoethyl)-N3-methyl-N1-(4-pyridyl)benzene-1,3-dicarboxamide CAS Name: 4-(1-aminoethyl)-N3-methyl-N1-pyridin-4-ylbenzene-1,3-dicarboxamide IUPAC Name: 4-(1-aminoethyl)-3-N-methyl-1-N-pyridin-4-ylbenzene-1,3-dicarboxamide Traditional Name: 4-(1-aminoethyl)-N'-methyl-N-(4-pyridyl)isophthalamide Formula: C16H18N4O2 MolecularWeight: 298.33972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C(C=C1)C(=O)NC2=CC=NC=C2)C(=O)NC)N

Isomeric SMILES

CC(C1=C(C=C(C=C1)C(=O)NC2=CC=NC=C2)C(=O)NC)N

InChI

InChI=1S/C16H18N4O2/c1-10(17)13-4-3-11(9-14(13)16(22)18-2)15(21)20-12-5-7-19-8-6-12/h3-10H,17H2,1-2H3,(H,18,22)(H,19,20,21)