10-[1,6-bis(azanyl)-3-phenyl-phenanthren-4-yl]decyl-trimethyl-azanium

Systemtic Name: 10-[1,6-bis(azanyl)-3-phenyl-phenanthren-4-yl]decyl-trimethyl-azanium Openeye Name: 10-(1,6-diamino-3-phenyl-4-phenanthryl)decyl-trimethyl-ammonium CAS Name: 10-(1,6-diamino-3-phenyl-4-phenanthrenyl)decyl-trimethylammonium IUPAC Name: 10-(1,6-diamino-3-phenylphenanthren-4-yl)decyl-trimethylazanium Traditional Name: 10-(1,6-diamino-3-phenyl-4-phenanthryl)decyl-trimethyl-ammonium Formula: C33H44N3+ MolecularWeight: 482.72256

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCCCCCCCCCC1=C2C(=C(C=C1C3=CC=CC=C3)N)C=CC4=C2C=C(C=C4)N

Isomeric SMILES

C[N+](C)(C)CCCCCCCCCCC1=C2C(=C(C=C1C3=CC=CC=C3)N)C=CC4=C2C=C(C=C4)N

InChI

InChI=1S/C33H44N3/c1-36(2,3)22-14-9-7-5-4-6-8-13-17-28-30(25-15-11-10-12-16-25)24-32(35)29-21-19-26-18-20-27(34)23-31(26)33(28)29/h10-12,15-16,18-21,23-24H,4-9,13-14,17,22,34-35H2,1-3H3/q+1