(2Z)-2-[1-[(2-methylpropan-2-yl)oxycarbonyl]azepan-4-ylidene]ethanoic acid

Systemtic Name: (2Z)-2-[1-[(2-methylpropan-2-yl)oxycarbonyl]azepan-4-ylidene]ethanoic acid Openeye Name: (2Z)-2-(1-tert-butoxycarbonylazepan-4-ylidene)acetic acid CAS Name: (2Z)-2-[1-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-azepanylidene]acetic acid IUPAC Name: (2Z)-2-[1-[(2-methylpropan-2-yl)oxycarbonyl]azepan-4-ylidene]acetic acid Traditional Name: (2Z)-2-(1-tert-butoxycarbonylazepan-4-ylidene)acetic acid Formula: C13H21NO4 MolecularWeight: 255.31014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(=CC(=O)O)CC1

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC/C(=C/C(=O)O)/CC1

InChI

InChI=1S/C13H21NO4/c1-13(2,3)18-12(17)14-7-4-5-10(6-8-14)9-11(15)16/h9H,4-8H2,1-3H3,(H,15,16)/b10-9-