3-methyl-1-[3-nitro-4-(4-phenylbutylamino)phenyl]pyrrolidine-2,5-dione

Systemtic Name: 3-methyl-1-[3-nitro-4-(4-phenylbutylamino)phenyl]pyrrolidine-2,5-dione Openeye Name: 3-methyl-1-[3-nitro-4-(4-phenylbutylamino)phenyl]pyrrolidine-2,5-dione CAS Name: 3-methyl-1-[3-nitro-4-(4-phenylbutylamino)phenyl]pyrrolidine-2,5-dione IUPAC Name: 3-methyl-1-[3-nitro-4-(4-phenylbutylamino)phenyl]pyrrolidine-2,5-dione Traditional Name: 3-methyl-1-[3-nitro-4-(4-phenylbutylamino)phenyl]pyrrolidine-2,5-quinone Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)N(C1=O)C2=CC(=C(C=C2)NCCCCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1CC(=O)N(C1=O)C2=CC(=C(C=C2)NCCCCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O4/c1-15-13-20(25)23(21(15)26)17-10-11-18(19(14-17)24(27)28)22-12-6-5-9-16-7-3-2-4-8-16/h2-4,7-8,10-11,14-15,22H,5-6,9,12-13H2,1H3