4-[cyclopropyl(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[cyclopropyl(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[cyclopropyl(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)amino]-4-oxo-butanoic acid CAS Name: 4-[cyclopropyl(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)amino]-4-oxobutanoic acid IUPAC Name: 4-[cyclopropyl(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)amino]-4-oxobutanoic acid Traditional Name: 4-[cyclopropyl(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)amino]-4-keto-butyric acid Formula: C16H19NO5 MolecularWeight: 305.32576

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CC2=CC3=C(C=C2)OCCO3)C(=O)CCC(=O)O

Isomeric SMILES

C1CC1N(CC2=CC3=C(C=C2)OCCO3)C(=O)CCC(=O)O

InChI

InChI=1S/C16H19NO5/c18-15(5-6-16(19)20)17(12-2-3-12)10-11-1-4-13-14(9-11)22-8-7-21-13/h1,4,9,12H,2-3,5-8,10H2,(H,19,20)