N-cyclohexylcyclohexanamine; 5-methoxy-1-(7-methoxy-1,3-benzodioxol-4-yl)-3-(4-methoxyphenyl)-2,3-dihydro-1H-indene-2-carboxylic acid

Systemtic Name: N-cyclohexylcyclohexanamine; 5-methoxy-1-(7-methoxy-1,3-benzodioxol-4-yl)-3-(4-methoxyphenyl)-2,3-dihydro-1H-indene-2-carboxylic acid Openeye Name: N-cyclohexylcyclohexanamine; 5-methoxy-1-(7-methoxy-1,3-benzodioxol-4-yl)-3-(4-methoxyphenyl)indane-2-carboxylic acid CAS Name: N-cyclohexylcyclohexanamine; 5-methoxy-1-(7-methoxy-1,3-benzodioxol-4-yl)-3-(4-methoxyphenyl)-2,3-dihydro-1H-indene-2-carboxylic acid IUPAC Name: N-cyclohexylcyclohexanamine; 5-methoxy-1-(7-methoxy-1,3-benzodioxol-4-yl)-3-(4-methoxyphenyl)-2,3-dihydro-1H-indene-2-carboxylic acid Traditional Name: dicyclohexylamine; 5-methoxy-1-(7-methoxy-1,3-benzodioxol-4-yl)-3-(4-methoxyphenyl)indane-2-carboxylic acid Formula: C38H47NO7 MolecularWeight: 629.78228

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(C(C3=C2C=C(C=C3)OC)C4=C5C(=C(C=C4)OC)OCO5)C(=O)O.C1CCC(CC1)NC2CCCCC2

Isomeric SMILES

COC1=CC=C(C=C1)C2C(C(C3=C2C=C(C=C3)OC)C4=C5C(=C(C=C4)OC)OCO5)C(=O)O.C1CCC(CC1)NC2CCCCC2

InChI

InChI=1S/C26H24O7.C12H23N/c1-29-15-6-4-14(5-7-15)21-19-12-16(30-2)8-9-17(19)22(23(21)26(27)28)18-10-11-20(31-3)25-24(18)32-13-33-25;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h4-12,21-23H,13H2,1-3H3,(H,27,28);11-13H,1-10H2