cyclohexyl-[6-[[(2S)-2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]methyl]-3,4-dihydro-1H-isoquinolin-2-yl]methanone

Systemtic Name: cyclohexyl-[6-[[(2S)-2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]methyl]-3,4-dihydro-1H-isoquinolin-2-yl]methanone Openeye Name: cyclohexyl-[6-[[(2S)-2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]methyl]-3,4-dihydro-1H-isoquinolin-2-yl]methanone CAS Name: cyclohexyl-[6-[[(2S)-2-(1-pyrrolidinylmethyl)-1-pyrrolidinyl]methyl]-3,4-dihydro-1H-isoquinolin-2-yl]methanone IUPAC Name: cyclohexyl-[6-[[(2S)-2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]methyl]-3,4-dihydro-1H-isoquinolin-2-yl]methanone Traditional Name: cyclohexyl-[6-[[(2S)-2-(pyrrolidinomethyl)pyrrolidino]methyl]-3,4-dihydro-1H-isoquinolin-2-yl]methanone Formula: C26H39N3O MolecularWeight: 409.60736

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N2CCC3=C(C2)C=CC(=C3)CN4CCCC4CN5CCCC5

Isomeric SMILES

C1CCC(CC1)C(=O)N2CCC3=C(C2)C=CC(=C3)CN4CCC[C@H]4CN5CCCC5

InChI

InChI=1S/C26H39N3O/c30-26(22-7-2-1-3-8-22)29-16-12-23-17-21(10-11-24(23)19-29)18-28-15-6-9-25(28)20-27-13-4-5-14-27/h10-11,17,22,25H,1-9,12-16,18-20H2/t25-/m0/s1