2-[4-[(2-methylpropan-2-yl)oxycarbonyl]-1,4-diazepan-1-yl]-2-phenyl-ethanoic acid

Systemtic Name: 2-[4-[(2-methylpropan-2-yl)oxycarbonyl]-1,4-diazepan-1-yl]-2-phenyl-ethanoic acid Openeye Name: 2-(4-tert-butoxycarbonyl-1,4-diazepan-1-yl)-2-phenyl-acetic acid CAS Name: 2-[4-[(2-methylpropan-2-yl)oxy-oxomethyl]-1,4-diazepan-1-yl]-2-phenylacetic acid IUPAC Name: 2-[4-[(2-methylpropan-2-yl)oxycarbonyl]-1,4-diazepan-1-yl]-2-phenylacetic acid Traditional Name: 2-(4-tert-butoxycarbonyl-1,4-diazepan-1-yl)-2-phenyl-acetic acid Formula: C18H26N2O4 MolecularWeight: 334.41004

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCN(CC1)C(C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCN(CC1)C(C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C18H26N2O4/c1-18(2,3)24-17(23)20-11-7-10-19(12-13-20)15(16(21)22)14-8-5-4-6-9-14/h4-6,8-9,15H,7,10-13H2,1-3H3,(H,21,22)