[2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl] 6-(aminocarbonylamino)hexanoate

Systemtic Name: [2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl] 6-(aminocarbonylamino)hexanoate Openeye Name: [2-(2-methyl-1H-indol-3-yl)-2-oxo-ethyl] 6-ureidohexanoate CAS Name: 6-(carbamoylamino)hexanoic acid [2-(2-methyl-1H-indol-3-yl)-2-oxoethyl] ester IUPAC Name: [2-(2-methyl-1H-indol-3-yl)-2-oxoethyl] 6-(carbamoylamino)hexanoate Traditional Name: 6-ureidohexanoic acid [2-keto-2-(2-methyl-1H-indol-3-yl)ethyl] ester Formula: C18H23N3O4 MolecularWeight: 345.39292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)COC(=O)CCCCCNC(=O)N

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)COC(=O)CCCCCNC(=O)N

InChI

InChI=1S/C18H23N3O4/c1-12-17(13-7-4-5-8-14(13)21-12)15(22)11-25-16(23)9-3-2-6-10-20-18(19)24/h4-5,7-8,21H,2-3,6,9-11H2,1H3,(H3,19,20,24)