2-(aminomethyl)-3-(4-oxidanylidenebutanoyl)-4-pyridin-3-yl-benzamide

Systemtic Name: 2-(aminomethyl)-3-(4-oxidanylidenebutanoyl)-4-pyridin-3-yl-benzamide Openeye Name: 2-(aminomethyl)-3-(4-oxobutanoyl)-4-(3-pyridyl)benzamide CAS Name: 2-(aminomethyl)-3-(1,4-dioxobutyl)-4-(3-pyridinyl)benzamide IUPAC Name: 2-(aminomethyl)-3-(4-oxobutanoyl)-4-pyridin-3-ylbenzamide Traditional Name: 2-(aminomethyl)-3-(4-ketobutanoyl)-4-(3-pyridyl)benzamide Formula: C17H17N3O3 MolecularWeight: 311.33518

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=C(C(=C(C=C2)C(=O)N)CN)C(=O)CCC=O

Isomeric SMILES

C1=CC(=CN=C1)C2=C(C(=C(C=C2)C(=O)N)CN)C(=O)CCC=O

InChI

InChI=1S/C17H17N3O3/c18-9-14-13(17(19)23)6-5-12(11-3-1-7-20-10-11)16(14)15(22)4-2-8-21/h1,3,5-8,10H,2,4,9,18H2,(H2,19,23)