N-[(E)-1-(1,3-benzodioxol-5-yl)-3-oxidanylidene-3-phenylazanyl-prop-1-en-2-yl]-4-(2-methylpropoxy)benzamide

Systemtic Name: N-[(E)-1-(1,3-benzodioxol-5-yl)-3-oxidanylidene-3-phenylazanyl-prop-1-en-2-yl]-4-(2-methylpropoxy)benzamide Openeye Name: N-[(E)-2-(1,3-benzodioxol-5-yl)-1-(phenylcarbamoyl)vinyl]-4-isobutoxy-benzamide CAS Name: N-[(E)-3-anilino-1-(1,3-benzodioxol-5-yl)-3-oxoprop-1-en-2-yl]-4-(2-methylpropoxy)benzamide IUPAC Name: N-[(E)-3-anilino-1-(1,3-benzodioxol-5-yl)-3-oxoprop-1-en-2-yl]-4-(2-methylpropoxy)benzamide Traditional Name: N-[(E)-2-(1,3-benzodioxol-5-yl)-1-(phenylcarbamoyl)vinyl]-4-isobutoxy-benzamide Formula: C27H26N2O5 MolecularWeight: 458.50574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)C(=O)NC(=CC2=CC3=C(C=C2)OCO3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)C(=O)N/C(=C/C2=CC3=C(C=C2)OCO3)/C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C27H26N2O5/c1-18(2)16-32-22-11-9-20(10-12-22)26(30)29-23(27(31)28-21-6-4-3-5-7-21)14-19-8-13-24-25(15-19)34-17-33-24/h3-15,18H,16-17H2,1-2H3,(H,28,31)(H,29,30)/b23-14+