[2,5-bis(oxidanylidene)pyrrolidin-1-yl] 3-[4-(9-methylacridin-1-yl)sulfonylphenyl]propanoate

Systemtic Name: [2,5-bis(oxidanylidene)pyrrolidin-1-yl] 3-[4-(9-methylacridin-1-yl)sulfonylphenyl]propanoate Openeye Name: (2,5-dioxopyrrolidin-1-yl) 3-[4-(9-methylacridin-1-yl)sulfonylphenyl]propanoate CAS Name: 3-[4-[(9-methyl-1-acridinyl)sulfonyl]phenyl]propanoic acid (2,5-dioxo-1-pyrrolidinyl) ester IUPAC Name: (2,5-dioxopyrrolidin-1-yl) 3-[4-(9-methylacridin-1-yl)sulfonylphenyl]propanoate Traditional Name: 3-[4-(9-methylacridin-1-yl)sulfonylphenyl]propionic acid succinimido ester Formula: C27H22N2O6S MolecularWeight: 502.53838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NC3=CC=CC=C13)C=CC=C2S(=O)(=O)C4=CC=C(C=C4)CCC(=O)ON5C(=O)CCC5=O

Isomeric SMILES

CC1=C2C(=NC3=CC=CC=C13)C=CC=C2S(=O)(=O)C4=CC=C(C=C4)CCC(=O)ON5C(=O)CCC5=O

InChI

InChI=1S/C27H22N2O6S/c1-17-20-5-2-3-6-21(20)28-22-7-4-8-23(27(17)22)36(33,34)19-12-9-18(10-13-19)11-16-26(32)35-29-24(30)14-15-25(29)31/h2-10,12-13H,11,14-16H2,1H3