2-adamantyl 3-methyl-3-(phenethylcarbamoyl)-4,9-dihydro-1H-pyrido[3,4-b]indole-2-carboxylate

Systemtic Name: 2-adamantyl 3-methyl-3-(phenethylcarbamoyl)-4,9-dihydro-1H-pyrido[3,4-b]indole-2-carboxylate Openeye Name: 2-adamantyl 3-methyl-3-(phenethylcarbamoyl)-4,9-dihydro-1H-pyrido[3,4-b]indole-2-carboxylate CAS Name: 3-methyl-3-[oxo-(phenethylamino)methyl]-4,9-dihydro-1H-pyrido[3,4-b]indole-2-carboxylic acid 2-adamantyl ester IUPAC Name: 2-adamantyl 3-methyl-3-(phenethylcarbamoyl)-4,9-dihydro-1H-pyrido[3,4-b]indole-2-carboxylate Traditional Name: 3-methyl-3-(phenethylcarbamoyl)-4,9-dihydro-1H-$b-carboline-2-carboxylic acid 2-adamantyl ester Formula: C32H37N3O3 MolecularWeight: 511.65448

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(CN1C(=O)OC3C4CC5CC(C4)CC3C5)NC6=CC=CC=C26)C(=O)NCCC7=CC=CC=C7

Isomeric SMILES

CC1(CC2=C(CN1C(=O)OC3C4CC5CC(C4)CC3C5)NC6=CC=CC=C26)C(=O)NCCC7=CC=CC=C7

InChI

InChI=1S/C32H37N3O3/c1-32(30(36)33-12-11-20-7-3-2-4-8-20)18-26-25-9-5-6-10-27(25)34-28(26)19-35(32)31(37)38-29-23-14-21-13-22(16-23)17-24(29)15-21/h2-10,21-24,29,34H,11-19H2,1H3,(H,33,36)