methyl 3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)propanoylamino]-6-methoxy-1H-indole-2-carboxylate

Systemtic Name: methyl 3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)propanoylamino]-6-methoxy-1H-indole-2-carboxylate Openeye Name: methyl 3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)propanoylamino]-6-methoxy-1H-indole-2-carboxylate CAS Name: 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropyl]amino]-6-methoxy-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)propanoylamino]-6-methoxy-1H-indole-2-carboxylate Traditional Name: 3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)propanoylamino]-6-methoxy-1H-indole-2-carboxylic acid methyl ester Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(NC2=C1C=CC(=C2)OC)C(=O)OC)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC(C(=O)NC1=C(NC2=C1C=CC(=C2)OC)C(=O)OC)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C23H25N3O4/c1-14(26-11-10-15-6-4-5-7-16(15)13-26)22(27)25-20-18-9-8-17(29-2)12-19(18)24-21(20)23(28)30-3/h4-9,12,14,24H,10-11,13H2,1-3H3,(H,25,27)