methyl 3-[2-[1,3-benzodioxol-5-yl(ethyl)amino]ethanoylamino]-6-methoxy-1H-indole-2-carboxylate

Systemtic Name: methyl 3-[2-[1,3-benzodioxol-5-yl(ethyl)amino]ethanoylamino]-6-methoxy-1H-indole-2-carboxylate Openeye Name: methyl 3-[[2-[1,3-benzodioxol-5-yl(ethyl)amino]acetyl]amino]-6-methoxy-1H-indole-2-carboxylate CAS Name: 3-[[2-[1,3-benzodioxol-5-yl(ethyl)amino]-1-oxoethyl]amino]-6-methoxy-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[[2-[1,3-benzodioxol-5-yl(ethyl)amino]acetyl]amino]-6-methoxy-1H-indole-2-carboxylate Traditional Name: 3-[[2-[1,3-benzodioxol-5-yl(ethyl)amino]acetyl]amino]-6-methoxy-1H-indole-2-carboxylic acid methyl ester Formula: C22H23N3O6 MolecularWeight: 425.43452

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O6/c1-4-25(13-5-8-17-18(9-13)31-12-30-17)11-19(26)24-20-15-7-6-14(28-2)10-16(15)23-21(20)22(27)29-3/h5-10,23H,4,11-12H2,1-3H3,(H,24,26)