4-methyl-2-[[(4-oxidanylidene-3,1-benzoxazin-2-yl)-propyl-carbamoyl]amino]pentanoic acid

Systemtic Name: 4-methyl-2-[[(4-oxidanylidene-3,1-benzoxazin-2-yl)-propyl-carbamoyl]amino]pentanoic acid Openeye Name: 4-methyl-2-[[(4-oxo-3,1-benzoxazin-2-yl)-propyl-carbamoyl]amino]pentanoic acid CAS Name: 4-methyl-2-[[oxo-[(4-oxo-3,1-benzoxazin-2-yl)-propylamino]methyl]amino]pentanoic acid IUPAC Name: 4-methyl-2-[[(4-oxo-3,1-benzoxazin-2-yl)-propylcarbamoyl]amino]pentanoic acid Traditional Name: 2-[[(4-keto-3,1-benzoxazin-2-yl)-propyl-carbamoyl]amino]-4-methyl-valeric acid Formula: C18H23N3O5 MolecularWeight: 361.39232

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=NC2=CC=CC=C2C(=O)O1)C(=O)NC(CC(C)C)C(=O)O

Isomeric SMILES

CCCN(C1=NC2=CC=CC=C2C(=O)O1)C(=O)NC(CC(C)C)C(=O)O

InChI

InChI=1S/C18H23N3O5/c1-4-9-21(17(25)19-14(15(22)23)10-11(2)3)18-20-13-8-6-5-7-12(13)16(24)26-18/h5-8,11,14H,4,9-10H2,1-3H3,(H,19,25)(H,22,23)