N'-[13,13-bis(4-methoxyphenyl)-12-phenyl-tridec-12-enyl]ethane-1,2-diamine

Systemtic Name: N'-[13,13-bis(4-methoxyphenyl)-12-phenyl-tridec-12-enyl]ethane-1,2-diamine Openeye Name: N'-[13,13-bis(4-methoxyphenyl)-12-phenyl-tridec-12-enyl]ethane-1,2-diamine CAS Name: N'-[13,13-bis(4-methoxyphenyl)-12-phenyltridec-12-enyl]ethane-1,2-diamine IUPAC Name: N'-[13,13-bis(4-methoxyphenyl)-12-phenyltridec-12-enyl]ethane-1,2-diamine Traditional Name: 2-aminoethyl-[13,13-bis(4-methoxyphenyl)-12-phenyl-tridec-12-enyl]amine Formula: C35H48N2O2 MolecularWeight: 528.76782

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=C(CCCCCCCCCCCNCCN)C2=CC=CC=C2)C3=CC=C(C=C3)OC

Isomeric SMILES

COC1=CC=C(C=C1)C(=C(CCCCCCCCCCCNCCN)C2=CC=CC=C2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C35H48N2O2/c1-38-32-22-18-30(19-23-32)35(31-20-24-33(39-2)25-21-31)34(29-15-11-10-12-16-29)17-13-8-6-4-3-5-7-9-14-27-37-28-26-36/h10-12,15-16,18-25,37H,3-9,13-14,17,26-28,36H2,1-2H3