N-[[(3Z)-3-[azanyl(benzamido)methylidene]-6-oxidanylidene-cyclohexa-1,4-dien-1-yl]methyl]-3-methyl-4-pyrrolidin-1-ylcarbonyl-benzamide

Systemtic Name: N-[[(3Z)-3-[azanyl(benzamido)methylidene]-6-oxidanylidene-cyclohexa-1,4-dien-1-yl]methyl]-3-methyl-4-pyrrolidin-1-ylcarbonyl-benzamide Openeye Name: N-[[(3Z)-3-[amino(benzamido)methylene]-6-oxo-cyclohexa-1,4-dien-1-yl]methyl]-3-methyl-4-(pyrrolidine-1-carbonyl)benzamide CAS Name: N-[[(3Z)-3-[amino(benzamido)methylidene]-6-oxo-1-cyclohexa-1,4-dienyl]methyl]-3-methyl-4-[oxo(1-pyrrolidinyl)methyl]benzamide IUPAC Name: N-[[(3Z)-3-[amino(benzamido)methylidene]-6-oxocyclohexa-1,4-dien-1-yl]methyl]-3-methyl-4-(pyrrolidine-1-carbonyl)benzamide Traditional Name: N-[[(3Z)-3-[amino(benzamido)methylene]-6-keto-cyclohexa-1,4-dien-1-yl]methyl]-3-methyl-4-(pyrrolidine-1-carbonyl)benzamide Formula: C28H28N4O4 MolecularWeight: 484.54632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCC2=CC(=C(N)NC(=O)C3=CC=CC=C3)C=CC2=O)C(=O)N4CCCC4

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCC2=C/C(=C(/N)\NC(=O)C3=CC=CC=C3)/C=CC2=O)C(=O)N4CCCC4

InChI

InChI=1S/C28H28N4O4/c1-18-15-21(9-11-23(18)28(36)32-13-5-6-14-32)26(34)30-17-22-16-20(10-12-24(22)33)25(29)31-27(35)19-7-3-2-4-8-19/h2-4,7-12,15-16H,5-6,13-14,17,29H2,1H3,(H,30,34)(H,31,35)/b25-20-