N-(3-chloranyl-4-methyl-phenyl)-N'-[(4-prop-2-ynoxyphenyl)methylideneamino]butanediamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-N'-[(4-prop-2-ynoxyphenyl)methylideneamino]butanediamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-N'-[(4-prop-2-ynoxyphenyl)methyleneamino]butanediamide CAS Name: N-(3-chloro-4-methylphenyl)-N'-[(4-prop-2-ynoxyphenyl)methylideneamino]butanediamide IUPAC Name: N-(3-chloro-4-methylphenyl)-N'-[(4-prop-2-ynoxyphenyl)methylideneamino]butanediamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-N'-[(4-propargyloxybenzylidene)amino]succinamide Formula: C21H20ClN3O3 MolecularWeight: 397.8548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCC(=O)NN=CC2=CC=C(C=C2)OCC#C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCC(=O)NN=CC2=CC=C(C=C2)OCC#C)Cl

InChI

InChI=1S/C21H20ClN3O3/c1-3-12-28-18-8-5-16(6-9-18)14-23-25-21(27)11-10-20(26)24-17-7-4-15(2)19(22)13-17/h1,4-9,13-14H,10-12H2,2H3,(H,24,26)(H,25,27)