N'-(isoquinolin-5-ylmethyl)-N-[(Z)-3-phenyl-3-(4-phenylphenyl)prop-2-enyl]ethane-1,2-diamine

Systemtic Name: N'-(isoquinolin-5-ylmethyl)-N-[(Z)-3-phenyl-3-(4-phenylphenyl)prop-2-enyl]ethane-1,2-diamine Openeye Name: N'-(5-isoquinolylmethyl)-N-[(Z)-3-phenyl-3-(4-phenylphenyl)allyl]ethane-1,2-diamine CAS Name: N'-(5-isoquinolinylmethyl)-N-[(Z)-3-phenyl-3-(4-phenylphenyl)prop-2-enyl]ethane-1,2-diamine IUPAC Name: N'-(isoquinolin-5-ylmethyl)-N-[(Z)-3-phenyl-3-(4-phenylphenyl)prop-2-enyl]ethane-1,2-diamine Traditional Name: 5-isoquinolylmethyl-[2-[[(Z)-3-phenyl-3-(4-phenylphenyl)allyl]amino]ethyl]amine Formula: C33H31N3 MolecularWeight: 469.61934

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=CCNCCNCC3=CC=CC4=C3C=CN=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)/C(=C\CNCCNCC3=CC=CC4=C3C=CN=C4)/C5=CC=CC=C5

InChI

InChI=1S/C33H31N3/c1-3-8-26(9-4-1)27-14-16-29(17-15-27)32(28-10-5-2-6-11-28)18-20-34-22-23-36-25-31-13-7-12-30-24-35-21-19-33(30)31/h1-19,21,24,34,36H,20,22-23,25H2/b32-18-