5-chloranyl-2-[4-(1,3-dioxolan-2-yl)pentyl]-3-phenyl-isoindole-1-carboxylic acid

Systemtic Name: 5-chloranyl-2-[4-(1,3-dioxolan-2-yl)pentyl]-3-phenyl-isoindole-1-carboxylic acid Openeye Name: 5-chloro-2-[4-(1,3-dioxolan-2-yl)pentyl]-3-phenyl-isoindole-1-carboxylic acid CAS Name: 5-chloro-2-[4-(1,3-dioxolan-2-yl)pentyl]-3-phenyl-1-isoindolecarboxylic acid IUPAC Name: 5-chloro-2-[4-(1,3-dioxolan-2-yl)pentyl]-3-phenylisoindole-1-carboxylic acid Traditional Name: 5-chloro-2-[4-(1,3-dioxolan-2-yl)pentyl]-3-phenyl-isoindole-1-carboxylic acid Formula: C23H24ClNO4 MolecularWeight: 413.89396

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCN1C(=C2C=C(C=CC2=C1C(=O)O)Cl)C3=CC=CC=C3)C4OCCO4

Isomeric SMILES

CC(CCCN1C(=C2C=C(C=CC2=C1C(=O)O)Cl)C3=CC=CC=C3)C4OCCO4

InChI

InChI=1S/C23H24ClNO4/c1-15(23-28-12-13-29-23)6-5-11-25-20(16-7-3-2-4-8-16)19-14-17(24)9-10-18(19)21(25)22(26)27/h2-4,7-10,14-15,23H,5-6,11-13H2,1H3,(H,26,27)