N-[[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl]oxy-phenyl-phosphoryl]pyridin-3-amine

Systemtic Name: N-[[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl]oxy-phenyl-phosphoryl]pyridin-3-amine Openeye Name: N-[[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexoxy]-phenyl-phosphoryl]pyridin-3-amine CAS Name: N-[[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxy-phenylphosphoryl]-3-pyridinamine IUPAC Name: N-[[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxy-phenylphosphoryl]pyridin-3-amine Traditional Name: [[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexoxy]-phenyl-phosphoryl]-(3-pyridyl)amine Formula: C21H29N2O2P MolecularWeight: 372.440921

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OP(=O)(C2=CC=CC=C2)NC3=CN=CC=C3)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)O[P@](=O)(C2=CC=CC=C2)NC3=CN=CC=C3)C(C)C

InChI

InChI=1S/C21H29N2O2P/c1-16(2)20-12-11-17(3)14-21(20)25-26(24,19-9-5-4-6-10-19)23-18-8-7-13-22-15-18/h4-10,13,15-17,20-21H,11-12,14H2,1-3H3,(H,23,24)/t17-,20+,21-,26-/m1/s1