N-cyclohexylcyclohexanamine; 1-(6-methoxy-1,3-benzodioxol-5-yl)-3-(4-methoxyphenyl)-5-propoxy-2,3-dihydro-1H-indene-2-carboxylic acid

Systemtic Name: N-cyclohexylcyclohexanamine; 1-(6-methoxy-1,3-benzodioxol-5-yl)-3-(4-methoxyphenyl)-5-propoxy-2,3-dihydro-1H-indene-2-carboxylic acid Openeye Name: N-cyclohexylcyclohexanamine; 1-(6-methoxy-1,3-benzodioxol-5-yl)-3-(4-methoxyphenyl)-5-propoxy-indane-2-carboxylic acid CAS Name: N-cyclohexylcyclohexanamine; 1-(6-methoxy-1,3-benzodioxol-5-yl)-3-(4-methoxyphenyl)-5-propoxy-2,3-dihydro-1H-indene-2-carboxylic acid IUPAC Name: N-cyclohexylcyclohexanamine; 1-(6-methoxy-1,3-benzodioxol-5-yl)-3-(4-methoxyphenyl)-5-propoxy-2,3-dihydro-1H-indene-2-carboxylic acid Traditional Name: dicyclohexylamine; 1-(6-methoxy-1,3-benzodioxol-5-yl)-3-(4-methoxyphenyl)-5-propoxy-indane-2-carboxylic acid Formula: C40H51NO7 MolecularWeight: 657.83544

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC2=C(C=C1)C(C(C2C3=CC=C(C=C3)OC)C(=O)O)C4=CC5=C(C=C4OC)OCO5.C1CCC(CC1)NC2CCCCC2

Isomeric SMILES

CCCOC1=CC2=C(C=C1)C(C(C2C3=CC=C(C=C3)OC)C(=O)O)C4=CC5=C(C=C4OC)OCO5.C1CCC(CC1)NC2CCCCC2

InChI

InChI=1S/C28H28O7.C12H23N/c1-4-11-33-18-9-10-19-20(12-18)25(16-5-7-17(31-2)8-6-16)27(28(29)30)26(19)21-13-23-24(35-15-34-23)14-22(21)32-3;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h5-10,12-14,25-27H,4,11,15H2,1-3H3,(H,29,30);11-13H,1-10H2