N-cyclohexylcyclohexanamine; 2-[methoxy(phenyl)phosphoryl]prop-2-enoic acid

Systemtic Name: N-cyclohexylcyclohexanamine; 2-[methoxy(phenyl)phosphoryl]prop-2-enoic acid Openeye Name: N-cyclohexylcyclohexanamine; 2-[methoxy(phenyl)phosphoryl]prop-2-enoic acid CAS Name: N-cyclohexylcyclohexanamine; 2-[methoxy(phenyl)phosphoryl]-2-propenoic acid IUPAC Name: N-cyclohexylcyclohexanamine; 2-[methoxy(phenyl)phosphoryl]prop-2-enoic acid Traditional Name: dicyclohexylamine; 2-[methoxy(phenyl)phosphoryl]acrylic acid Formula: C22H34NO4P MolecularWeight: 407.483421

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COP(=O)(C1=CC=CC=C1)C(=C)C(=O)O.C1CCC(CC1)NC2CCCCC2

Isomeric SMILES

CO[P@](=O)(C1=CC=CC=C1)C(=C)C(=O)O.C1CCC(CC1)NC2CCCCC2

InChI

InChI=1S/C12H23N.C10H11O4P/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-8(10(11)12)15(13,14-2)9-6-4-3-5-7-9/h11-13H,1-10H2;3-7H,1H2,2H3,(H,11,12)/t;15-/m.0/s1