tert-butyl 3-[4-(9-aminocarbonyloxyacridin-1-yl)sulfonylphenyl]propanoate

Systemtic Name: tert-butyl 3-[4-(9-aminocarbonyloxyacridin-1-yl)sulfonylphenyl]propanoate Openeye Name: tert-butyl 3-[4-(9-carbamoyloxyacridin-1-yl)sulfonylphenyl]propanoate CAS Name: 3-[4-[(9-carbamoyloxy-1-acridinyl)sulfonyl]phenyl]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[4-(9-carbamoyloxyacridin-1-yl)sulfonylphenyl]propanoate Traditional Name: 3-[4-(9-carbamoyloxyacridin-1-yl)sulfonylphenyl]propionic acid tert-butyl ester Formula: C27H26N2O6S MolecularWeight: 506.57014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCC1=CC=C(C=C1)S(=O)(=O)C2=CC=CC3=NC4=CC=CC=C4C(=C32)OC(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)CCC1=CC=C(C=C1)S(=O)(=O)C2=CC=CC3=NC4=CC=CC=C4C(=C32)OC(=O)N

InChI

InChI=1S/C27H26N2O6S/c1-27(2,3)35-23(30)16-13-17-11-14-18(15-12-17)36(32,33)22-10-6-9-21-24(22)25(34-26(28)31)19-7-4-5-8-20(19)29-21/h4-12,14-15H,13,16H2,1-3H3,(H2,28,31)