ethyl N-[11-[3-[(8aR)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]propanoyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate

Systemtic Name: ethyl N-[11-[3-[(8aR)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]propanoyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate Openeye Name: ethyl N-[11-[3-[(8aR)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]propanoyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate CAS Name: N-[11-[3-[(8aR)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]-1-oxopropyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[11-[3-[(8aR)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]propanoyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate Traditional Name: N-[11-[3-[(8aR)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]propanoyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamic acid ethyl ester Formula: C27H34N4O3 MolecularWeight: 462.58386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC2=C(CCC3=CC=CC=C3N2C(=O)CCN4CCN5CCCC5C4)C=C1

Isomeric SMILES

CCOC(=O)NC1=CC2=C(CCC3=CC=CC=C3N2C(=O)CCN4CCN5CCC[C@@H]5C4)C=C1

InChI

InChI=1S/C27H34N4O3/c1-2-34-27(33)28-22-12-11-21-10-9-20-6-3-4-8-24(20)31(25(21)18-22)26(32)13-15-29-16-17-30-14-5-7-23(30)19-29/h3-4,6,8,11-12,18,23H,2,5,7,9-10,13-17,19H2,1H3,(H,28,33)/t23-/m1/s1