3-[[4-(aminomethyl)pyridin-2-yl]-(4-chlorophenyl)amino]-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[[4-(aminomethyl)pyridin-2-yl]-(4-chlorophenyl)amino]-3-oxidanylidene-propanoic acid Openeye Name: 3-(N-[4-(aminomethyl)-2-pyridyl]-4-chloro-anilino)-3-oxo-propanoic acid CAS Name: 3-(N-[4-(aminomethyl)-2-pyridinyl]-4-chloroanilino)-3-oxopropanoic acid IUPAC Name: 3-(N-[4-(aminomethyl)pyridin-2-yl]-4-chloroanilino)-3-oxopropanoic acid Traditional Name: 3-(N-[4-(aminomethyl)-2-pyridyl]-4-chloro-anilino)-3-keto-propionic acid Formula: C15H14ClN3O3 MolecularWeight: 319.74296

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N(C2=NC=CC(=C2)CN)C(=O)CC(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1N(C2=NC=CC(=C2)CN)C(=O)CC(=O)O)Cl

InChI

InChI=1S/C15H14ClN3O3/c16-11-1-3-12(4-2-11)19(14(20)8-15(21)22)13-7-10(9-17)5-6-18-13/h1-7H,8-9,17H2,(H,21,22)