2-[2-[methyl-[3-methyl-2-(pyridin-4-ylmethylamino)butanoyl]amino]propanoylamino]butanedioic acid

Systemtic Name: 2-[2-[methyl-[3-methyl-2-(pyridin-4-ylmethylamino)butanoyl]amino]propanoylamino]butanedioic acid Openeye Name: 2-[2-[methyl-[3-methyl-2-(4-pyridylmethylamino)butanoyl]amino]propanoylamino]butanedioic acid CAS Name: 2-[[2-[methyl-[3-methyl-1-oxo-2-(pyridin-4-ylmethylamino)butyl]amino]-1-oxopropyl]amino]butanedioic acid IUPAC Name: 2-[2-[methyl-[3-methyl-2-(pyridin-4-ylmethylamino)butanoyl]amino]propanoylamino]butanedioic acid Traditional Name: 2-[2-[methyl-[3-methyl-2-(4-pyridylmethylamino)butanoyl]amino]propanoylamino]succinic acid Formula: C19H28N4O6 MolecularWeight: 408.44882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N(C)C(C)C(=O)NC(CC(=O)O)C(=O)O)NCC1=CC=NC=C1

Isomeric SMILES

CC(C)C(C(=O)N(C)C(C)C(=O)NC(CC(=O)O)C(=O)O)NCC1=CC=NC=C1

InChI

InChI=1S/C19H28N4O6/c1-11(2)16(21-10-13-5-7-20-8-6-13)18(27)23(4)12(3)17(26)22-14(19(28)29)9-15(24)25/h5-8,11-12,14,16,21H,9-10H2,1-4H3,(H,22,26)(H,24,25)(H,28,29)