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

Systemtic Name: 1-methyl-7-[4-(4-phenylpiperazin-1-yl)butyl]-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione Openeye Name: 1-methyl-7-[4-(4-phenylpiperazin-1-yl)butyl]-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione CAS Name: 1-methyl-7-[4-(4-phenyl-1-piperazinyl)butyl]-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione IUPAC Name: 1-methyl-7-[4-(4-phenylpiperazin-1-yl)butyl]-5,6-dihydropyrrolo[2,3-c]azepine-4,8-dione Traditional Name: 1-methyl-7-[4-(4-phenylpiperazino)butyl]-5,6-dihydropyrrol[2,3-c]azepine-4,8-quinone Formula: C23H30N4O2 MolecularWeight: 394.5099

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C1C(=O)N(CCC2=O)CCCCN3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CN1C=CC2=C1C(=O)N(CCC2=O)CCCCN3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C23H30N4O2/c1-24-13-9-20-21(28)10-14-27(23(29)22(20)24)12-6-5-11-25-15-17-26(18-16-25)19-7-3-2-4-8-19/h2-4,7-9,13H,5-6,10-12,14-18H2,1H3