2-[(3-methylphenyl)methyl]-1,4-bis[4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]butane-1,4-dione

Systemtic Name: 2-[(3-methylphenyl)methyl]-1,4-bis[4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]butane-1,4-dione Openeye Name: 2-(m-tolylmethyl)-1,4-bis[4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidyl]butane-1,4-dione CAS Name: 2-[(3-methylphenyl)methyl]-1,4-bis[4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidinyl]butane-1,4-dione IUPAC Name: 2-[(3-methylphenyl)methyl]-1,4-bis[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]butane-1,4-dione Traditional Name: 1,4-bis[4-(2-keto-3H-benzimidazol-1-yl)piperidino]-2-(3-methylbenzyl)butane-1,4-dione Formula: C36H40N6O4 MolecularWeight: 620.7406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC(CC(=O)N2CCC(CC2)N3C4=CC=CC=C4NC3=O)C(=O)N5CCC(CC5)N6C7=CC=CC=C7NC6=O

Isomeric SMILES

CC1=CC(=CC=C1)CC(CC(=O)N2CCC(CC2)N3C4=CC=CC=C4NC3=O)C(=O)N5CCC(CC5)N6C7=CC=CC=C7NC6=O

InChI

InChI=1S/C36H40N6O4/c1-24-7-6-8-25(21-24)22-26(34(44)40-19-15-28(16-20-40)42-32-12-5-3-10-30(32)38-36(42)46)23-33(43)39-17-13-27(14-18-39)41-31-11-4-2-9-29(31)37-35(41)45/h2-12,21,26-28H,13-20,22-23H2,1H3,(H,37,45)(H,38,46)