4-chloranyl-N-(2-methylpropyl)-N-[(2E)-2-(phenylmethylidene)heptyl]benzamide

Systemtic Name: 4-chloranyl-N-(2-methylpropyl)-N-[(2E)-2-(phenylmethylidene)heptyl]benzamide Openeye Name: N-[(2E)-2-benzylideneheptyl]-4-chloro-N-isobutyl-benzamide CAS Name: 4-chloro-N-(2-methylpropyl)-N-[(2E)-2-(phenylmethylene)heptyl]benzamide IUPAC Name: N-[(2E)-2-benzylideneheptyl]-4-chloro-N-(2-methylpropyl)benzamide Traditional Name: N-[(E)-2-amyl-3-phenyl-allyl]-4-chloro-N-isobutyl-benzamide Formula: C25H32ClNO MolecularWeight: 397.98068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=CC1=CC=CC=C1)CN(CC(C)C)C(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCC/C(=C\C1=CC=CC=C1)/CN(CC(C)C)C(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C25H32ClNO/c1-4-5-7-12-22(17-21-10-8-6-9-11-21)19-27(18-20(2)3)25(28)23-13-15-24(26)16-14-23/h6,8-11,13-17,20H,4-5,7,12,18-19H2,1-3H3/b22-17+