propan-2-yl 3-(2-dimethylaminoethylcarbamoyl)-1,1-dimethyl-2,6-dihydroazepino[4,5-b]indole-5-carboxylate

Systemtic Name: propan-2-yl 3-(2-dimethylaminoethylcarbamoyl)-1,1-dimethyl-2,6-dihydroazepino[4,5-b]indole-5-carboxylate Openeye Name: isopropyl 3-(2-dimethylaminoethylcarbamoyl)-1,1-dimethyl-2,6-dihydroazepino[4,5-b]indole-5-carboxylate CAS Name: 3-[(2-dimethylaminoethylamino)-oxomethyl]-1,1-dimethyl-2,6-dihydroazepino[4,5-b]indole-5-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-(2-dimethylaminoethylcarbamoyl)-1,1-dimethyl-2,6-dihydroazepino[4,5-b]indole-5-carboxylate Traditional Name: 3-(2-dimethylaminoethylcarbamoyl)-1,1-dimethyl-2,6-dihydroazepin[4,5-b]indole-5-carboxylic acid isopropyl ester Formula: C23H32N4O3 MolecularWeight: 412.52518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CN(CC(C2=C1NC3=CC=CC=C32)(C)C)C(=O)NCCN(C)C

Isomeric SMILES

CC(C)OC(=O)C1=CN(CC(C2=C1NC3=CC=CC=C32)(C)C)C(=O)NCCN(C)C

InChI

InChI=1S/C23H32N4O3/c1-15(2)30-21(28)17-13-27(22(29)24-11-12-26(5)6)14-23(3,4)19-16-9-7-8-10-18(16)25-20(17)19/h7-10,13,15,25H,11-12,14H2,1-6H3,(H,24,29)