[3-[4-(2-butoxyethoxy)phenyl]-2-(2-methylpentylamino)phenyl] prop-2-enoate

Systemtic Name: [3-[4-(2-butoxyethoxy)phenyl]-2-(2-methylpentylamino)phenyl] prop-2-enoate Openeye Name: [3-[4-(2-butoxyethoxy)phenyl]-2-(2-methylpentylamino)phenyl] prop-2-enoate CAS Name: 2-propenoic acid [3-[4-(2-butoxyethoxy)phenyl]-2-(2-methylpentylamino)phenyl] ester IUPAC Name: [3-[4-(2-butoxyethoxy)phenyl]-2-(2-methylpentylamino)phenyl] prop-2-enoate Traditional Name: acrylic acid [3-[4-(2-butoxyethoxy)phenyl]-2-(2-methylpentylamino)phenyl] ester Formula: C27H37NO4 MolecularWeight: 439.58698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCOC1=CC=C(C=C1)C2=C(C(=CC=C2)OC(=O)C=C)NCC(C)CCC

Isomeric SMILES

CCCCOCCOC1=CC=C(C=C1)C2=C(C(=CC=C2)OC(=O)C=C)NCC(C)CCC

InChI

InChI=1S/C27H37NO4/c1-5-8-17-30-18-19-31-23-15-13-22(14-16-23)24-11-9-12-25(32-26(29)7-3)27(24)28-20-21(4)10-6-2/h7,9,11-16,21,28H,3,5-6,8,10,17-20H2,1-2,4H3