methyl 5-ethanoyl-4-(9H-pyrido[3,4-b]indol-1-ylmethyl)-1,4-dihydropyridine-3-carboxylate

Systemtic Name: methyl 5-ethanoyl-4-(9H-pyrido[3,4-b]indol-1-ylmethyl)-1,4-dihydropyridine-3-carboxylate Openeye Name: methyl 5-acetyl-4-(9H-pyrido[3,4-b]indol-1-ylmethyl)-1,4-dihydropyridine-3-carboxylate CAS Name: 5-acetyl-4-(9H-pyrido[3,4-b]indol-1-ylmethyl)-1,4-dihydropyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 5-acetyl-4-(9H-pyrido[3,4-b]indol-1-ylmethyl)-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-acetyl-4-(9H-$b-carbolin-1-ylmethyl)-1,4-dihydropyridine-3-carboxylic acid methyl ester Formula: C21H19N3O3 MolecularWeight: 361.39386

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CNC=C(C1CC2=NC=CC3=C2NC4=CC=CC=C34)C(=O)OC

Isomeric SMILES

CC(=O)C1=CNC=C(C1CC2=NC=CC3=C2NC4=CC=CC=C34)C(=O)OC

InChI

InChI=1S/C21H19N3O3/c1-12(25)16-10-22-11-17(21(26)27-2)15(16)9-19-20-14(7-8-23-19)13-5-3-4-6-18(13)24-20/h3-8,10-11,15,22,24H,9H2,1-2H3