methyl 3-[2-[1,3-benzodioxol-5-yl(ethyl)amino]ethanoylamino]-5-methyl-1H-indole-2-carboxylate

Systemtic Name: methyl 3-[2-[1,3-benzodioxol-5-yl(ethyl)amino]ethanoylamino]-5-methyl-1H-indole-2-carboxylate Openeye Name: methyl 3-[[2-[1,3-benzodioxol-5-yl(ethyl)amino]acetyl]amino]-5-methyl-1H-indole-2-carboxylate CAS Name: 3-[[2-[1,3-benzodioxol-5-yl(ethyl)amino]-1-oxoethyl]amino]-5-methyl-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[[2-[1,3-benzodioxol-5-yl(ethyl)amino]acetyl]amino]-5-methyl-1H-indole-2-carboxylate Traditional Name: 3-[[2-[1,3-benzodioxol-5-yl(ethyl)amino]acetyl]amino]-5-methyl-1H-indole-2-carboxylic acid methyl ester Formula: C22H23N3O5 MolecularWeight: 409.43512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC1=C(NC2=C1C=C(C=C2)C)C(=O)OC)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCN(CC(=O)NC1=C(NC2=C1C=C(C=C2)C)C(=O)OC)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H23N3O5/c1-4-25(14-6-8-17-18(10-14)30-12-29-17)11-19(26)24-20-15-9-13(2)5-7-16(15)23-21(20)22(27)28-3/h5-10,23H,4,11-12H2,1-3H3,(H,24,26)