propan-2-yl (3S)-3-(2-chlorophenyl)-3-[2-(9-oxidanylideneacridin-10-yl)ethanoylamino]propanoate

Systemtic Name: propan-2-yl (3S)-3-(2-chlorophenyl)-3-[2-(9-oxidanylideneacridin-10-yl)ethanoylamino]propanoate Openeye Name: isopropyl (3S)-3-(2-chlorophenyl)-3-[[2-(9-oxoacridin-10-yl)acetyl]amino]propanoate CAS Name: (3S)-3-(2-chlorophenyl)-3-[[1-oxo-2-(9-oxo-10-acridinyl)ethyl]amino]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl (3S)-3-(2-chlorophenyl)-3-[[2-(9-oxoacridin-10-yl)acetyl]amino]propanoate Traditional Name: (3S)-3-(2-chlorophenyl)-3-[[2-(9-ketoacridin-10-yl)acetyl]amino]propionic acid isopropyl ester Formula: C27H25ClN2O4 MolecularWeight: 476.9514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1=CC=CC=C1Cl)NC(=O)CN2C3=CC=CC=C3C(=O)C4=CC=CC=C42

Isomeric SMILES

CC(C)OC(=O)C[C@@H](C1=CC=CC=C1Cl)NC(=O)CN2C3=CC=CC=C3C(=O)C4=CC=CC=C42

InChI

InChI=1S/C27H25ClN2O4/c1-17(2)34-26(32)15-22(18-9-3-6-12-21(18)28)29-25(31)16-30-23-13-7-4-10-19(23)27(33)20-11-5-8-14-24(20)30/h3-14,17,22H,15-16H2,1-2H3,(H,29,31)/t22-/m0/s1