methyl 3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethanoylamino]-4-methoxy-1H-indole-2-carboxylate

Systemtic Name: methyl 3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethanoylamino]-4-methoxy-1H-indole-2-carboxylate Openeye Name: methyl 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-4-methoxy-1H-indole-2-carboxylate CAS Name: 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxoethyl]amino]-4-methoxy-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-4-methoxy-1H-indole-2-carboxylate Traditional Name: 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-4-methoxy-1H-indole-2-carboxylic acid methyl ester Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1C(=C(N2)C(=O)OC)NC(=O)CN3CCC4=CC=CC=C4C3

Isomeric SMILES

COC1=CC=CC2=C1C(=C(N2)C(=O)OC)NC(=O)CN3CCC4=CC=CC=C4C3

InChI

InChI=1S/C22H23N3O4/c1-28-17-9-5-8-16-19(17)20(21(23-16)22(27)29-2)24-18(26)13-25-11-10-14-6-3-4-7-15(14)12-25/h3-9,23H,10-13H2,1-2H3,(H,24,26)