2-(3,4-dihydro-2H-chromen-3-ylcarbonylamino)-3-methyl-pentanoic acid

Systemtic Name: 2-(3,4-dihydro-2H-chromen-3-ylcarbonylamino)-3-methyl-pentanoic acid Openeye Name: 2-(chromane-3-carbonylamino)-3-methyl-pentanoic acid CAS Name: 2-[[3,4-dihydro-2H-1-benzopyran-3-yl(oxo)methyl]amino]-3-methylpentanoic acid IUPAC Name: 2-(3,4-dihydro-2H-chromene-3-carbonylamino)-3-methylpentanoic acid Traditional Name: 2-(chroman-3-carbonylamino)-3-methyl-valeric acid Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)C1CC2=CC=CC=C2OC1

Isomeric SMILES

CCC(C)C(C(=O)O)NC(=O)C1CC2=CC=CC=C2OC1

InChI

InChI=1S/C16H21NO4/c1-3-10(2)14(16(19)20)17-15(18)12-8-11-6-4-5-7-13(11)21-9-12/h4-7,10,12,14H,3,8-9H2,1-2H3,(H,17,18)(H,19,20)