(4Z)-4-hydroxyimino-1-methyl-7-[3-(4-phenylpiperazin-1-yl)propyl]-5,6-dihydropyrrolo[2,3-c]azepin-8-one

Systemtic Name: (4Z)-4-hydroxyimino-1-methyl-7-[3-(4-phenylpiperazin-1-yl)propyl]-5,6-dihydropyrrolo[2,3-c]azepin-8-one Openeye Name: (4Z)-4-hydroxyimino-1-methyl-7-[3-(4-phenylpiperazin-1-yl)propyl]-5,6-dihydropyrrolo[2,3-c]azepin-8-one CAS Name: (4Z)-4-hydroxyimino-1-methyl-7-[3-(4-phenyl-1-piperazinyl)propyl]-5,6-dihydropyrrolo[2,3-c]azepin-8-one IUPAC Name: (4Z)-4-hydroxyimino-1-methyl-7-[3-(4-phenylpiperazin-1-yl)propyl]-5,6-dihydropyrrolo[2,3-c]azepin-8-one Traditional Name: (4Z)-4-hydroximino-1-methyl-7-[3-(4-phenylpiperazino)propyl]-5,6-dihydropyrrol[2,3-c]azepin-8-one Formula: C22H29N5O2 MolecularWeight: 395.49796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C1C(=O)N(CCC2=NO)CCCN3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CN1C=CC\2=C1C(=O)N(CC/C2=N/O)CCCN3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H29N5O2/c1-24-12-8-19-20(23-29)9-13-27(22(28)21(19)24)11-5-10-25-14-16-26(17-15-25)18-6-3-2-4-7-18/h2-4,6-8,12,29H,5,9-11,13-17H2,1H3/b23-20-