4-azanyl-2-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]isoindole-1,3-dione

Systemtic Name: 4-azanyl-2-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]isoindole-1,3-dione Openeye Name: 4-amino-2-[2-(azepan-1-yl)-2-oxo-ethyl]isoindoline-1,3-dione CAS Name: 4-amino-2-[2-(1-azepanyl)-2-oxoethyl]isoindole-1,3-dione IUPAC Name: 4-amino-2-[2-(azepan-1-yl)-2-oxoethyl]isoindole-1,3-dione Traditional Name: 4-amino-2-[2-(azepan-1-yl)-2-keto-ethyl]isoindoline-1,3-quinone Formula: C16H19N3O3 MolecularWeight: 301.34036

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2C(=O)C3=C(C2=O)C(=CC=C3)N

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2C(=O)C3=C(C2=O)C(=CC=C3)N

InChI

InChI=1S/C16H19N3O3/c17-12-7-5-6-11-14(12)16(22)19(15(11)21)10-13(20)18-8-3-1-2-4-9-18/h5-7H,1-4,8-10,17H2