dodecyl 4-[4-[(3-methyl-1-oxidanylidene-4H-benzo[f]quinazolin-9-yl)methylamino]phenyl]-4-oxidanylidene-butanoate

Systemtic Name: dodecyl 4-[4-[(3-methyl-1-oxidanylidene-4H-benzo[f]quinazolin-9-yl)methylamino]phenyl]-4-oxidanylidene-butanoate Openeye Name: dodecyl 4-[4-[(3-methyl-1-oxo-4H-benzo[f]quinazolin-9-yl)methylamino]phenyl]-4-oxo-butanoate CAS Name: 4-[4-[(3-methyl-1-oxo-4H-benzo[f]quinazolin-9-yl)methylamino]phenyl]-4-oxobutanoic acid dodecyl ester IUPAC Name: dodecyl 4-[4-[(3-methyl-1-oxo-4H-benzo[f]quinazolin-9-yl)methylamino]phenyl]-4-oxobutanoate Traditional Name: 4-keto-4-[4-[(1-keto-3-methyl-4H-benzo[f]quinazolin-9-yl)methylamino]phenyl]butyric acid lauryl ester Formula: C36H45N3O4 MolecularWeight: 583.7602

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)CCC(=O)C1=CC=C(C=C1)NCC2=CC3=C(C=C2)C=CC4=C3C(=O)N=C(N4)C

Isomeric SMILES

CCCCCCCCCCCCOC(=O)CCC(=O)C1=CC=C(C=C1)NCC2=CC3=C(C=C2)C=CC4=C3C(=O)N=C(N4)C

InChI

InChI=1S/C36H45N3O4/c1-3-4-5-6-7-8-9-10-11-12-23-43-34(41)22-21-33(40)29-15-18-30(19-16-29)37-25-27-13-14-28-17-20-32-35(31(28)24-27)36(42)39-26(2)38-32/h13-20,24,37H,3-12,21-23,25H2,1-2H3,(H,38,39,42)