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

Systemtic Name: 7-[4-(4-hydroxyphenyl)piperazin-1-yl]-1-methyl-5-propyl-6,7-dihydropyrrolo[3,2-c]azepine-4,8-dione Openeye Name: 7-[4-(4-hydroxyphenyl)piperazin-1-yl]-1-methyl-5-propyl-6,7-dihydropyrrolo[3,2-c]azepine-4,8-dione CAS Name: 7-[4-(4-hydroxyphenyl)-1-piperazinyl]-1-methyl-5-propyl-6,7-dihydropyrrolo[3,2-c]azepine-4,8-dione IUPAC Name: 7-[4-(4-hydroxyphenyl)piperazin-1-yl]-1-methyl-5-propyl-6,7-dihydropyrrolo[3,2-c]azepine-4,8-dione Traditional Name: 7-[4-(4-hydroxyphenyl)piperazino]-1-methyl-5-propyl-6,7-dihydropyrrol[3,2-c]azepine-4,8-quinone Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CC(C(=O)C2=C(C1=O)C=CN2C)N3CCN(CC3)C4=CC=C(C=C4)O

Isomeric SMILES

CCCN1CC(C(=O)C2=C(C1=O)C=CN2C)N3CCN(CC3)C4=CC=C(C=C4)O

InChI

InChI=1S/C22H28N4O3/c1-3-9-26-15-19(21(28)20-18(22(26)29)8-10-23(20)2)25-13-11-24(12-14-25)16-4-6-17(27)7-5-16/h4-8,10,19,27H,3,9,11-15H2,1-2H3