1-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propyl]indole-6-carboxylic acid

Systemtic Name: 1-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propyl]indole-6-carboxylic acid Openeye Name: 1-[3-(tert-butoxycarbonylamino)propyl]indole-6-carboxylic acid CAS Name: 1-[3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propyl]-6-indolecarboxylic acid IUPAC Name: 1-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propyl]indole-6-carboxylic acid Traditional Name: 1-[3-(tert-butoxycarbonylamino)propyl]indole-6-carboxylic acid Formula: C17H22N2O4 MolecularWeight: 318.36758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCN1C=CC2=C1C=C(C=C2)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NCCCN1C=CC2=C1C=C(C=C2)C(=O)O

InChI

InChI=1S/C17H22N2O4/c1-17(2,3)23-16(22)18-8-4-9-19-10-7-12-5-6-13(15(20)21)11-14(12)19/h5-7,10-11H,4,8-9H2,1-3H3,(H,18,22)(H,20,21)