4-methoxy-3-methyl-benzaldehyde; 2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid

Systemtic Name: 4-methoxy-3-methyl-benzaldehyde; 2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid Openeye Name: 2-(tert-butoxycarbonylamino)butanoic acid; 4-methoxy-3-methyl-benzaldehyde CAS Name: 4-methoxy-3-methylbenzaldehyde; 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butanoic acid IUPAC Name: 4-methoxy-3-methylbenzaldehyde; 2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid Traditional Name: 2-(tert-butoxycarbonylamino)butyric acid; 4-methoxy-3-methyl-benzaldehyde Formula: C18H27NO6 MolecularWeight: 353.41008

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC(=O)OC(C)(C)C.CC1=C(C=CC(=C1)C=O)OC

Isomeric SMILES

CCC(C(=O)O)NC(=O)OC(C)(C)C.CC1=C(C=CC(=C1)C=O)OC

InChI

InChI=1S/C9H17NO4.C9H10O2/c1-5-6(7(11)12)10-8(13)14-9(2,3)4;1-7-5-8(6-10)3-4-9(7)11-2/h6H,5H2,1-4H3,(H,10,13)(H,11,12);3-6H,1-2H3