4-[methyl(phenyl)amino]-4-(3-oxidanylidene-1,2-dihydroisoindol-1-yl)-4-piperidin-4-yl-butanal hydrochloride

Systemtic Name: 4-[methyl(phenyl)amino]-4-(3-oxidanylidene-1,2-dihydroisoindol-1-yl)-4-piperidin-4-yl-butanal hydrochloride Openeye Name: 4-(N-methylanilino)-4-(3-oxoisoindolin-1-yl)-4-(4-piperidyl)butanal hydrochloride CAS Name: 4-(N-methylanilino)-4-(3-oxo-1,2-dihydroisoindol-1-yl)-4-(4-piperidinyl)butanal hydrochloride IUPAC Name: 4-(N-methylanilino)-4-(3-oxo-1,2-dihydroisoindol-1-yl)-4-piperidin-4-ylbutanal hydrochloride Traditional Name: 4-(3-ketoisoindolin-1-yl)-4-(N-methylanilino)-4-(4-piperidyl)butyraldehyde hydrochloride Formula: C24H30ClN3O2 MolecularWeight: 427.9669

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C(CCC=O)(C2CCNCC2)C3C4=CC=CC=C4C(=O)N3.Cl

Isomeric SMILES

CN(C1=CC=CC=C1)C(CCC=O)(C2CCNCC2)C3C4=CC=CC=C4C(=O)N3.Cl

InChI

InChI=1S/C24H29N3O2.ClH/c1-27(19-8-3-2-4-9-19)24(14-7-17-28,18-12-15-25-16-13-18)22-20-10-5-6-11-21(20)23(29)26-22;/h2-6,8-11,17-18,22,25H,7,12-16H2,1H3,(H,26,29);1H