(E)-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-N-[(2R)-2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl]prop-2-enamide

Systemtic Name: (E)-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-N-[(2R)-2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl]prop-2-enamide Openeye Name: (E)-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-N-[(2R)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]prop-2-enamide CAS Name: (E)-3-(1-cyclopropyl-2,5-dimethyl-3-pyrrolyl)-N-[(2R)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]-2-propenamide IUPAC Name: (E)-3-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-N-[(2R)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]prop-2-enamide Traditional Name: (E)-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-N-[(2R)-3-keto-2-methyl-4H-1,4-benzoxazin-6-yl]acrylamide Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)C=CC3=C(N(C(=C3)C)C4CC4)C

Isomeric SMILES

C[C@@H]1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)/C=C/C3=C(N(C(=C3)C)C4CC4)C

InChI

InChI=1S/C21H23N3O3/c1-12-10-15(13(2)24(12)17-6-7-17)4-9-20(25)22-16-5-8-19-18(11-16)23-21(26)14(3)27-19/h4-5,8-11,14,17H,6-7H2,1-3H3,(H,22,25)(H,23,26)/b9-4+/t14-/m1/s1