3-(2-azanylethyl)-5-(2-hydroxyethyloxy)-1-[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl]carbonyl-benzimidazol-2-one

Systemtic Name: 3-(2-azanylethyl)-5-(2-hydroxyethyloxy)-1-[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl]carbonyl-benzimidazol-2-one Openeye Name: 3-(2-aminoethyl)-5-(2-hydroxyethoxy)-1-[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexanecarbonyl]benzimidazol-2-one CAS Name: 3-(2-aminoethyl)-5-(2-hydroxyethoxy)-1-[[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]-oxomethyl]-2-benzimidazolone IUPAC Name: 3-(2-aminoethyl)-5-(2-hydroxyethoxy)-1-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexanecarbonyl]benzimidazol-2-one Traditional Name: 3-(2-aminoethyl)-5-(2-hydroxyethoxy)-1-[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexanecarbonyl]benzimidazol-2-one Formula: C22H33N3O4 MolecularWeight: 403.51512

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)C(=O)N2C3=C(C=C(C=C3)OCCO)N(C2=O)CCN)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)C(=O)N2C3=C(C=C(C=C3)OCCO)N(C2=O)CCN)C(C)C

InChI

InChI=1S/C22H33N3O4/c1-14(2)17-6-4-15(3)12-18(17)21(27)25-19-7-5-16(29-11-10-26)13-20(19)24(9-8-23)22(25)28/h5,7,13-15,17-18,26H,4,6,8-12,23H2,1-3H3/t15-,17+,18-/m1/s1