(11-nonan-5-yloxy-11-oxidanylidene-undecyl) 4-[[9-(dimethylamino)benzo[a]phenoxazin-5-ylidene]amino]benzoate

Systemtic Name: (11-nonan-5-yloxy-11-oxidanylidene-undecyl) 4-[[9-(dimethylamino)benzo[a]phenoxazin-5-ylidene]amino]benzoate Openeye Name: [11-(1-butylpentoxy)-11-oxo-undecyl] 4-[[9-(dimethylamino)benzo[a]phenoxazin-5-ylidene]amino]benzoate CAS Name: 4-[[9-(dimethylamino)-5-benzo[a]phenoxazinylidene]amino]benzoic acid (11-nonan-5-yloxy-11-oxoundecyl) ester IUPAC Name: (11-nonan-5-yloxy-11-oxoundecyl) 4-[[9-(dimethylamino)benzo[a]phenoxazin-5-ylidene]amino]benzoate Traditional Name: 4-[[9-(dimethylamino)benzo[a]phenoxazin-5-ylidene]amino]benzoic acid [11-(1-butylpentoxy)-11-keto-undecyl] ester Formula: C45H57N3O5 MolecularWeight: 719.95118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCCC)OC(=O)CCCCCCCCCCOC(=O)C1=CC=C(C=C1)N=C2C=C3C(=NC4=C(O3)C=C(C=C4)N(C)C)C5=CC=CC=C52

Isomeric SMILES

CCCCC(CCCC)OC(=O)CCCCCCCCCCOC(=O)C1=CC=C(C=C1)N=C2C=C3C(=NC4=C(O3)C=C(C=C4)N(C)C)C5=CC=CC=C52

InChI

InChI=1S/C45H57N3O5/c1-5-7-19-36(20-8-6-2)52-43(49)23-15-13-11-9-10-12-14-18-30-51-45(50)33-24-26-34(27-25-33)46-40-32-42-44(38-22-17-16-21-37(38)40)47-39-29-28-35(48(3)4)31-41(39)53-42/h16-17,21-22,24-29,31-32,36H,5-15,18-20,23,30H2,1-4H3