(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl 4-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]butanoate

Systemtic Name: (5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl 4-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]butanoate Openeye Name: (5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl 4-(2,5-dioxopyrrolidin-1-yl)butanoate CAS Name: 4-(2,5-dioxo-1-pyrrolidinyl)butanoic acid (5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methyl ester IUPAC Name: (5-chloro-3-methyl-1-phenylpyrazol-4-yl)methyl 4-(2,5-dioxopyrrolidin-1-yl)butanoate Traditional Name: 4-succinimidobutyric acid (5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl ester Formula: C19H20ClN3O4 MolecularWeight: 389.8328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1COC(=O)CCCN2C(=O)CCC2=O)Cl)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1COC(=O)CCCN2C(=O)CCC2=O)Cl)C3=CC=CC=C3

InChI

InChI=1S/C19H20ClN3O4/c1-13-15(19(20)23(21-13)14-6-3-2-4-7-14)12-27-18(26)8-5-11-22-16(24)9-10-17(22)25/h2-4,6-7H,5,8-12H2,1H3