2-[(3S,7R)-2-oxidanylidene-7-propyl-azepan-3-yl]isoindole-1,3-dione

Systemtic Name: 2-[(3S,7R)-2-oxidanylidene-7-propyl-azepan-3-yl]isoindole-1,3-dione Openeye Name: 2-[(3S,7R)-2-oxo-7-propyl-azepan-3-yl]isoindoline-1,3-dione CAS Name: 2-[(3S,7R)-2-oxo-7-propyl-3-azepanyl]isoindole-1,3-dione IUPAC Name: 2-[(3S,7R)-2-oxo-7-propylazepan-3-yl]isoindole-1,3-dione Traditional Name: 2-[(3S,7R)-2-keto-7-propyl-azepan-3-yl]isoindoline-1,3-quinone Formula: C17H20N2O3 MolecularWeight: 300.3523

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCCC(C(=O)N1)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCC[C@@H]1CCC[C@@H](C(=O)N1)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C17H20N2O3/c1-2-6-11-7-5-10-14(15(20)18-11)19-16(21)12-8-3-4-9-13(12)17(19)22/h3-4,8-9,11,14H,2,5-7,10H2,1H3,(H,18,20)/t11-,14+/m1/s1