N-[2-(4-butylphenyl)-6-methyl-benzotriazol-5-yl]-4-(2-oxidanylidenechromen-3-yl)benzamide

Systemtic Name: N-[2-(4-butylphenyl)-6-methyl-benzotriazol-5-yl]-4-(2-oxidanylidenechromen-3-yl)benzamide Openeye Name: N-[2-(4-butylphenyl)-6-methyl-benzotriazol-5-yl]-4-(2-oxochromen-3-yl)benzamide CAS Name: N-[2-(4-butylphenyl)-6-methyl-5-benzotriazolyl]-4-(2-oxo-1-benzopyran-3-yl)benzamide IUPAC Name: N-[2-(4-butylphenyl)-6-methylbenzotriazol-5-yl]-4-(2-oxochromen-3-yl)benzamide Traditional Name: N-[2-(4-butylphenyl)-6-methyl-benzotriazol-5-yl]-4-(2-ketochromen-3-yl)benzamide Formula: C33H28N4O3 MolecularWeight: 528.60042

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=O)C4=CC=C(C=C4)C5=CC6=CC=CC=C6OC5=O)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=O)C4=CC=C(C=C4)C5=CC6=CC=CC=C6OC5=O)C

InChI

InChI=1S/C33H28N4O3/c1-3-4-7-22-10-16-26(17-11-22)37-35-29-18-21(2)28(20-30(29)36-37)34-32(38)24-14-12-23(13-15-24)27-19-25-8-5-6-9-31(25)40-33(27)39/h5-6,8-20H,3-4,7H2,1-2H3,(H,34,38)