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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(=O)C2=C(C1=O)C=CN2CCCCN3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CN1CCC(=O)C2=C(C1=O)C=CN2CCCCN3CCN(CC3)C4=CC=CC=C4

InChI

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