5-butyl-6-[4-(4-chlorophenyl)piperazin-1-yl]-7-methyl-4-(oxidanylamino)-5,6-dihydropyrrolo[2,3-c]azepin-8-one

Systemtic Name: 5-butyl-6-[4-(4-chlorophenyl)piperazin-1-yl]-7-methyl-4-(oxidanylamino)-5,6-dihydropyrrolo[2,3-c]azepin-8-one Openeye Name: 5-butyl-6-[4-(4-chlorophenyl)piperazin-1-yl]-4-(hydroxyamino)-7-methyl-5,6-dihydropyrrolo[2,3-c]azepin-8-one CAS Name: 5-butyl-6-[4-(4-chlorophenyl)-1-piperazinyl]-4-(hydroxyamino)-7-methyl-5,6-dihydropyrrolo[2,3-c]azepin-8-one IUPAC Name: 5-butyl-6-[4-(4-chlorophenyl)piperazin-1-yl]-4-(hydroxyamino)-7-methyl-5,6-dihydropyrrolo[2,3-c]azepin-8-one Traditional Name: 5-butyl-6-[4-(4-chlorophenyl)piperazino]-4-(hydroxyamino)-7-methyl-5,6-dihydropyrrol[2,3-c]azepin-8-one Formula: C23H30ClN5O2 MolecularWeight: 443.9696

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(N(C(=O)C2=NC=CC2=C1NO)C)N3CCN(CC3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCCCC1C(N(C(=O)C2=NC=CC2=C1NO)C)N3CCN(CC3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H30ClN5O2/c1-3-4-5-19-20(26-31)18-10-11-25-21(18)23(30)27(2)22(19)29-14-12-28(13-15-29)17-8-6-16(24)7-9-17/h6-11,19,22,26,31H,3-5,12-15H2,1-2H3