2-[2-[(1-ethoxy-4-methyl-1-oxidanylidene-pentan-2-yl)amino]propanoyl-pyridin-3-yl-amino]ethanoic acid

Systemtic Name: 2-[2-[(1-ethoxy-4-methyl-1-oxidanylidene-pentan-2-yl)amino]propanoyl-pyridin-3-yl-amino]ethanoic acid Openeye Name: 2-[2-[(1-ethoxycarbonyl-3-methyl-butyl)amino]propanoyl-(3-pyridyl)amino]acetic acid CAS Name: 2-[[2-[(1-ethoxy-4-methyl-1-oxopentan-2-yl)amino]-1-oxopropyl]-(3-pyridinyl)amino]acetic acid IUPAC Name: 2-[2-[(1-ethoxy-4-methyl-1-oxopentan-2-yl)amino]propanoyl-pyridin-3-ylamino]acetic acid Traditional Name: 2-[2-[(1-carbethoxy-3-methyl-butyl)amino]propanoyl-(3-pyridyl)amino]acetic acid Formula: C18H27N3O5 MolecularWeight: 365.42408

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(C)C)NC(C)C(=O)N(CC(=O)O)C1=CN=CC=C1

Isomeric SMILES

CCOC(=O)C(CC(C)C)NC(C)C(=O)N(CC(=O)O)C1=CN=CC=C1

InChI

InChI=1S/C18H27N3O5/c1-5-26-18(25)15(9-12(2)3)20-13(4)17(24)21(11-16(22)23)14-7-6-8-19-10-14/h6-8,10,12-13,15,20H,5,9,11H2,1-4H3,(H,22,23)