2-[[4-(4-phenylpiperazin-1-yl)butan-2-ylamino]methylidene]indene-1,3-dione hydrochloride

Systemtic Name: 2-[[4-(4-phenylpiperazin-1-yl)butan-2-ylamino]methylidene]indene-1,3-dione hydrochloride Openeye Name: 2-[[[1-methyl-3-(4-phenylpiperazin-1-yl)propyl]amino]methylene]indane-1,3-dione hydrochloride CAS Name: 2-[[4-(4-phenyl-1-piperazinyl)butan-2-ylamino]methylidene]indene-1,3-dione hydrochloride IUPAC Name: 2-[[4-(4-phenylpiperazin-1-yl)butan-2-ylamino]methylidene]indene-1,3-dione hydrochloride Traditional Name: 2-[[[1-methyl-3-(4-phenylpiperazino)propyl]amino]methylene]indane-1,3-quinone hydrochloride Formula: C24H28ClN3O2 MolecularWeight: 425.95102

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCN1CCN(CC1)C2=CC=CC=C2)NC=C3C(=O)C4=CC=CC=C4C3=O.Cl

Isomeric SMILES

CC(CCN1CCN(CC1)C2=CC=CC=C2)NC=C3C(=O)C4=CC=CC=C4C3=O.Cl

InChI

InChI=1S/C24H27N3O2.ClH/c1-18(25-17-22-23(28)20-9-5-6-10-21(20)24(22)29)11-12-26-13-15-27(16-14-26)19-7-3-2-4-8-19;/h2-10,17-18,25H,11-16H2,1H3;1H