3-[[4-[4-(phenylmethyl)piperidin-1-yl]carbonylphenyl]amino]-2-propan-2-yl-3H-isoindol-1-one

Systemtic Name: 3-[[4-[4-(phenylmethyl)piperidin-1-yl]carbonylphenyl]amino]-2-propan-2-yl-3H-isoindol-1-one Openeye Name: 3-[4-(4-benzylpiperidine-1-carbonyl)anilino]-2-isopropyl-isoindolin-1-one CAS Name: 3-[4-[oxo-[4-(phenylmethyl)-1-piperidinyl]methyl]anilino]-2-propan-2-yl-3H-isoindol-1-one IUPAC Name: 3-[4-(4-benzylpiperidine-1-carbonyl)anilino]-2-propan-2-yl-3H-isoindol-1-one Traditional Name: 3-[4-(4-benzylpiperidine-1-carbonyl)anilino]-2-isopropyl-isoindolin-1-one Formula: C30H33N3O2 MolecularWeight: 467.60192

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(C2=CC=CC=C2C1=O)NC3=CC=C(C=C3)C(=O)N4CCC(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC(C)N1C(C2=CC=CC=C2C1=O)NC3=CC=C(C=C3)C(=O)N4CCC(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C30H33N3O2/c1-21(2)33-28(26-10-6-7-11-27(26)30(33)35)31-25-14-12-24(13-15-25)29(34)32-18-16-23(17-19-32)20-22-8-4-3-5-9-22/h3-15,21,23,28,31H,16-20H2,1-2H3