N-[(E)-(3-bromanyl-5-methoxy-4-prop-2-enoxy-phenyl)methylideneamino]-4-[(4-phenylpiperazin-1-yl)methyl]benzamide

Systemtic Name: N-[(E)-(3-bromanyl-5-methoxy-4-prop-2-enoxy-phenyl)methylideneamino]-4-[(4-phenylpiperazin-1-yl)methyl]benzamide Openeye Name: N-[(E)-(4-allyloxy-3-bromo-5-methoxy-phenyl)methyleneamino]-4-[(4-phenylpiperazin-1-yl)methyl]benzamide CAS Name: N-[(E)-(3-bromo-5-methoxy-4-prop-2-enoxyphenyl)methylideneamino]-4-[(4-phenyl-1-piperazinyl)methyl]benzamide IUPAC Name: N-[(E)-(3-bromo-5-methoxy-4-prop-2-enoxyphenyl)methylideneamino]-4-[(4-phenylpiperazin-1-yl)methyl]benzamide Traditional Name: N-[(E)-(4-allyloxy-3-bromo-5-methoxy-benzylidene)amino]-4-[(4-phenylpiperazino)methyl]benzamide Formula: C29H31BrN4O3 MolecularWeight: 563.48544

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=NNC(=O)C2=CC=C(C=C2)CN3CCN(CC3)C4=CC=CC=C4)Br)OCC=C

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=N/NC(=O)C2=CC=C(C=C2)CN3CCN(CC3)C4=CC=CC=C4)Br)OCC=C

InChI

InChI=1S/C29H31BrN4O3/c1-3-17-37-28-26(30)18-23(19-27(28)36-2)20-31-32-29(35)24-11-9-22(10-12-24)21-33-13-15-34(16-14-33)25-7-5-4-6-8-25/h3-12,18-20H,1,13-17,21H2,2H3,(H,32,35)/b31-20+