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5-ethyl-6-phenyl-phenanthridin-5-ium-3,8-diamine; 2,3,3-trimethylbutane-1,2-diamine

5-ethyl-6-phenyl-phenanthridin-5-ium-3,8-diamine; 2,3,3-trimethylbutane-1,2-diamine

Systemtic Name:5-ethyl-6-phenyl-phenanthridin-5-ium-3,8-diamine; 2,3,3-trimethylbutane-1,2-diamine
Openeye Name:5-ethyl-6-phenyl-phenanthridin-5-ium-3,8-diamine; 2,3,3-trimethylbutane-1,2-diamine
CAS Name:5-ethyl-6-phenylphenanthridin-5-ium-3,8-diamine; 2,3,3-trimethylbutane-1,2-diamine
IUPAC Name:5-ethyl-6-phenylphenanthridin-5-ium-3,8-diamine; 2,3,3-trimethylbutane-1,2-diamine
Traditional Name:(3-amino-5-ethyl-6-phenyl-phenanthridin-5-ium-8-yl)amine; [1-(aminomethyl)-1,2,2-trimethyl-propyl]amine
Formula: C28H38N5+
MolecularWeight: 444.63482
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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C2C=C(C=CC2=C3C=CC(=CC3=C1C4=CC=CC=C4)N)N.CC(C)(C)C(C)(CN)N


Isomeric SMILES

CC[N+]1=C2C=C(C=CC2=C3C=CC(=CC3=C1C4=CC=CC=C4)N)N.CC(C)(C)C(C)(CN)N


InChI

InChI=1S/C21H19N3.C7H18N2/c1-2-24-20-13-16(23)9-11-18(20)17-10-8-15(22)12-19(17)21(24)14-6-4-3-5-7-14;1-6(2,3)7(4,9)5-8/h3-13,23H,2,22H2,1H3;5,8-9H2,1-4H3/p+1


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