(6-methyl-9-prop-2-ynoxy-1,2,4,5-tetrahydroazepino[4,5-b]indol-3-yl)-phenyl-methanone

Systemtic Name: (6-methyl-9-prop-2-ynoxy-1,2,4,5-tetrahydroazepino[4,5-b]indol-3-yl)-phenyl-methanone Openeye Name: (6-methyl-9-prop-2-ynoxy-1,2,4,5-tetrahydroazepino[4,5-b]indol-3-yl)-phenyl-methanone CAS Name: (6-methyl-9-prop-2-ynoxy-1,2,4,5-tetrahydroazepino[4,5-b]indol-3-yl)-phenylmethanone IUPAC Name: (6-methyl-9-prop-2-ynoxy-1,2,4,5-tetrahydroazepino[4,5-b]indol-3-yl)-phenylmethanone Traditional Name: (6-methyl-9-propargyloxy-1,2,4,5-tetrahydroazepin[4,5-b]indol-3-yl)-phenyl-methanone Formula: C23H22N2O2 MolecularWeight: 358.43298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CCN(CC2)C(=O)C3=CC=CC=C3)C4=C1C=CC(=C4)OCC#C

Isomeric SMILES

CN1C2=C(CCN(CC2)C(=O)C3=CC=CC=C3)C4=C1C=CC(=C4)OCC#C

InChI

InChI=1S/C23H22N2O2/c1-3-15-27-18-9-10-21-20(16-18)19-11-13-25(14-12-22(19)24(21)2)23(26)17-7-5-4-6-8-17/h1,4-10,16H,11-15H2,2H3