N-[(E)-(5-bromanyl-2-prop-2-ynoxy-phenyl)methylideneamino]-4-butoxy-benzamide

Systemtic Name: N-[(E)-(5-bromanyl-2-prop-2-ynoxy-phenyl)methylideneamino]-4-butoxy-benzamide Openeye Name: N-[(E)-(5-bromo-2-prop-2-ynoxy-phenyl)methyleneamino]-4-butoxy-benzamide CAS Name: N-[(E)-(5-bromo-2-prop-2-ynoxyphenyl)methylideneamino]-4-butoxybenzamide IUPAC Name: N-[(E)-(5-bromo-2-prop-2-ynoxyphenyl)methylideneamino]-4-butoxybenzamide Traditional Name: N-[(E)-(5-bromo-2-propargyloxy-benzylidene)amino]-4-butoxy-benzamide Formula: C21H21BrN2O3 MolecularWeight: 429.30704

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NN=CC2=C(C=CC(=C2)Br)OCC#C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N/N=C/C2=C(C=CC(=C2)Br)OCC#C

InChI

InChI=1S/C21H21BrN2O3/c1-3-5-13-26-19-9-6-16(7-10-19)21(25)24-23-15-17-14-18(22)8-11-20(17)27-12-4-2/h2,6-11,14-15H,3,5,12-13H2,1H3,(H,24,25)/b23-15+