3,4-bis(phenylmethoxy)benzaldehyde; cyclohexanamine

Systemtic Name: 3,4-bis(phenylmethoxy)benzaldehyde; cyclohexanamine Openeye Name: cyclohexanamine; 3,4-dibenzyloxybenzaldehyde CAS Name: 3,4-bis(phenylmethoxy)benzaldehyde; cyclohexanamine IUPAC Name: 3,4-bis(phenylmethoxy)benzaldehyde; cyclohexanamine Traditional Name: cyclohexylamine; 3,4-dibenzoxybenzaldehyde Formula: C27H31NO3 MolecularWeight: 417.53994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N.C1=CC=C(C=C1)COC2=C(C=C(C=C2)C=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)N.C1=CC=C(C=C1)COC2=C(C=C(C=C2)C=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H18O3.C6H13N/c22-14-19-11-12-20(23-15-17-7-3-1-4-8-17)21(13-19)24-16-18-9-5-2-6-10-18;7-6-4-2-1-3-5-6/h1-14H,15-16H2;6H,1-5,7H2