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4-oxidanylidene-4-phenylazanyl-3-(pyridin-3-ylmethylamino)butanoic acid

4-oxidanylidene-4-phenylazanyl-3-(pyridin-3-ylmethylamino)butanoic acid

Systemtic Name:4-oxidanylidene-4-phenylazanyl-3-(pyridin-3-ylmethylamino)butanoic acid
Openeye Name:4-anilino-4-oxo-3-(3-pyridylmethylamino)butanoic acid
CAS Name:4-anilino-4-oxo-3-(3-pyridinylmethylamino)butanoic acid
IUPAC Name:4-anilino-4-oxo-3-(pyridin-3-ylmethylamino)butanoic acid
Traditional Name:4-anilino-4-keto-3-(3-pyridylmethylamino)butyric acid
Formula: C16H17N3O3
MolecularWeight: 299.32448
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C(CC(=O)O)NCC2=CN=CC=C2


Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C(CC(=O)O)NCC2=CN=CC=C2


InChI

InChI=1S/C16H17N3O3/c20-15(21)9-14(18-11-12-5-4-8-17-10-12)16(22)19-13-6-2-1-3-7-13/h1-8,10,14,18H,9,11H2,(H,19,22)(H,20,21)


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