N-[(E)-(2-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)methylideneamino]-4-(2,5-dimethylpyrrol-1-yl)benzamide

Systemtic Name: N-[(E)-(2-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)methylideneamino]-4-(2,5-dimethylpyrrol-1-yl)benzamide Openeye Name: N-[(E)-(4-benzyloxy-2-bromo-5-methoxy-phenyl)methyleneamino]-4-(2,5-dimethylpyrrol-1-yl)benzamide CAS Name: N-[(E)-(2-bromo-5-methoxy-4-phenylmethoxyphenyl)methylideneamino]-4-(2,5-dimethyl-1-pyrrolyl)benzamide IUPAC Name: N-[(E)-(2-bromo-5-methoxy-4-phenylmethoxyphenyl)methylideneamino]-4-(2,5-dimethylpyrrol-1-yl)benzamide Traditional Name: N-[(E)-(4-benzoxy-2-bromo-5-methoxy-benzylidene)amino]-4-(2,5-dimethylpyrrol-1-yl)benzamide Formula: C28H26BrN3O3 MolecularWeight: 532.42834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)NN=CC3=CC(=C(C=C3Br)OCC4=CC=CC=C4)OC)C

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)N/N=C/C3=CC(=C(C=C3Br)OCC4=CC=CC=C4)OC)C

InChI

InChI=1S/C28H26BrN3O3/c1-19-9-10-20(2)32(19)24-13-11-22(12-14-24)28(33)31-30-17-23-15-26(34-3)27(16-25(23)29)35-18-21-7-5-4-6-8-21/h4-17H,18H2,1-3H3,(H,31,33)/b30-17+