methyl 5-ethanoyl-4-[(9-methylpyrido[3,4-b]indol-1-yl)methyl]-1,4-dihydropyridine-3-carboxylate

Systemtic Name: methyl 5-ethanoyl-4-[(9-methylpyrido[3,4-b]indol-1-yl)methyl]-1,4-dihydropyridine-3-carboxylate Openeye Name: methyl 5-acetyl-4-[(9-methylpyrido[3,4-b]indol-1-yl)methyl]-1,4-dihydropyridine-3-carboxylate CAS Name: 5-acetyl-4-[(9-methyl-1-pyrido[3,4-b]indolyl)methyl]-1,4-dihydropyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 5-acetyl-4-[(9-methylpyrido[3,4-b]indol-1-yl)methyl]-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-acetyl-4-[(9-methyl-$b-carbolin-1-yl)methyl]-1,4-dihydropyridine-3-carboxylic acid methyl ester Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CNC=C(C1CC2=NC=CC3=C2N(C4=CC=CC=C34)C)C(=O)OC

Isomeric SMILES

CC(=O)C1=CNC=C(C1CC2=NC=CC3=C2N(C4=CC=CC=C34)C)C(=O)OC

InChI

InChI=1S/C22H21N3O3/c1-13(26)17-11-23-12-18(22(27)28-3)16(17)10-19-21-15(8-9-24-19)14-6-4-5-7-20(14)25(21)2/h4-9,11-12,16,23H,10H2,1-3H3