7-(phenylmethyl)-1-[2-(4-phenylpiperazin-1-yl)ethyl]-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione

Systemtic Name: 7-(phenylmethyl)-1-[2-(4-phenylpiperazin-1-yl)ethyl]-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione Openeye Name: 7-benzyl-1-[2-(4-phenylpiperazin-1-yl)ethyl]-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione CAS Name: 7-(phenylmethyl)-1-[2-(4-phenyl-1-piperazinyl)ethyl]-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione IUPAC Name: 7-benzyl-1-[2-(4-phenylpiperazin-1-yl)ethyl]-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione Traditional Name: 7-benzyl-1-[2-(4-phenylpiperazino)ethyl]-5,6-dihydropyrrol[2,3-c]azepine-4,8-quinone Formula: C27H30N4O2 MolecularWeight: 442.5527

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C2=C(C1=O)C=CN2CCN3CCN(CC3)C4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

C1CN(C(=O)C2=C(C1=O)C=CN2CCN3CCN(CC3)C4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C27H30N4O2/c32-25-12-14-31(21-22-7-3-1-4-8-22)27(33)26-24(25)11-13-30(26)20-17-28-15-18-29(19-16-28)23-9-5-2-6-10-23/h1-11,13H,12,14-21H2