1-methyl-7-[4-oxidanylidene-4-[4-(phenylmethyl)piperazin-1-yl]butoxy]-3H-imidazo[4,5-b]quinolin-2-one

Systemtic Name: 1-methyl-7-[4-oxidanylidene-4-[4-(phenylmethyl)piperazin-1-yl]butoxy]-3H-imidazo[4,5-b]quinolin-2-one Openeye Name: 7-[4-(4-benzylpiperazin-1-yl)-4-oxo-butoxy]-1-methyl-3H-imidazo[4,5-b]quinolin-2-one CAS Name: 1-methyl-7-[4-oxo-4-[4-(phenylmethyl)-1-piperazinyl]butoxy]-3H-imidazo[4,5-b]quinolin-2-one IUPAC Name: 7-[4-(4-benzylpiperazin-1-yl)-4-oxobutoxy]-1-methyl-3H-imidazo[4,5-b]quinolin-2-one Traditional Name: 7-[4-(4-benzylpiperazino)-4-keto-butoxy]-1-methyl-3H-imidazo[4,5-b]quinolin-2-one Formula: C26H29N5O3 MolecularWeight: 459.54016

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(NC1=O)N=C3C=CC(=CC3=C2)OCCCC(=O)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CN1C2=C(NC1=O)N=C3C=CC(=CC3=C2)OCCCC(=O)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C26H29N5O3/c1-29-23-17-20-16-21(9-10-22(20)27-25(23)28-26(29)33)34-15-5-8-24(32)31-13-11-30(12-14-31)18-19-6-3-2-4-7-19/h2-4,6-7,9-10,16-17H,5,8,11-15,18H2,1H3,(H,27,28,33)