N-[2-methyl-1-(5-methyl-4-oxidanylidene-3,1-benzoxazin-2-yl)propyl]-1-[(E)-3-phenylprop-2-enoyl]pyrrolidine-2-carboxamide

Systemtic Name: N-[2-methyl-1-(5-methyl-4-oxidanylidene-3,1-benzoxazin-2-yl)propyl]-1-[(E)-3-phenylprop-2-enoyl]pyrrolidine-2-carboxamide Openeye Name: N-[2-methyl-1-(5-methyl-4-oxo-3,1-benzoxazin-2-yl)propyl]-1-[(E)-3-phenylprop-2-enoyl]pyrrolidine-2-carboxamide CAS Name: N-[2-methyl-1-(5-methyl-4-oxo-3,1-benzoxazin-2-yl)propyl]-1-[(E)-1-oxo-3-phenylprop-2-enyl]-2-pyrrolidinecarboxamide IUPAC Name: N-[2-methyl-1-(5-methyl-4-oxo-3,1-benzoxazin-2-yl)propyl]-1-[(E)-3-phenylprop-2-enoyl]pyrrolidine-2-carboxamide Traditional Name: N-[1-(4-keto-5-methyl-3,1-benzoxazin-2-yl)-2-methyl-propyl]-1-[(E)-3-phenylacryloyl]pyrrolidine-2-carboxamide Formula: C27H29N3O4 MolecularWeight: 459.53686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N=C(OC2=O)C(C(C)C)NC(=O)C3CCCN3C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

CC1=C2C(=CC=C1)N=C(OC2=O)C(C(C)C)NC(=O)C3CCCN3C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C27H29N3O4/c1-17(2)24(26-28-20-12-7-9-18(3)23(20)27(33)34-26)29-25(32)21-13-8-16-30(21)22(31)15-14-19-10-5-4-6-11-19/h4-7,9-12,14-15,17,21,24H,8,13,16H2,1-3H3,(H,29,32)/b15-14+