[4-cyclopropyl-3-(3-imidazol-1-ylphenyl)-2-(3-oxidanylidenepropanoylamino)phenyl]carbamic acid

Systemtic Name: [4-cyclopropyl-3-(3-imidazol-1-ylphenyl)-2-(3-oxidanylidenepropanoylamino)phenyl]carbamic acid Openeye Name: [4-cyclopropyl-3-(3-imidazol-1-ylphenyl)-2-(3-oxopropanoylamino)phenyl]carbamic acid CAS Name: [4-cyclopropyl-2-(1,3-dioxopropylamino)-3-[3-(1-imidazolyl)phenyl]phenyl]carbamic acid IUPAC Name: [4-cyclopropyl-3-(3-imidazol-1-ylphenyl)-2-(3-oxopropanoylamino)phenyl]carbamic acid Traditional Name: [4-cyclopropyl-3-(3-imidazol-1-ylphenyl)-2-(3-ketopropanoylamino)phenyl]carbamic acid Formula: C22H20N4O4 MolecularWeight: 404.4186

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=C(C(=C(C=C2)NC(=O)O)NC(=O)CC=O)C3=CC(=CC=C3)N4C=CN=C4

Isomeric SMILES

C1CC1C2=C(C(=C(C=C2)NC(=O)O)NC(=O)CC=O)C3=CC(=CC=C3)N4C=CN=C4

InChI

InChI=1S/C22H20N4O4/c27-11-8-19(28)25-21-18(24-22(29)30)7-6-17(14-4-5-14)20(21)15-2-1-3-16(12-15)26-10-9-23-13-26/h1-3,6-7,9-14,24H,4-5,8H2,(H,25,28)(H,29,30)