4-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[3-(2-oxidanylideneazepan-1-yl)propyl]butanamide

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[3-(2-oxidanylideneazepan-1-yl)propyl]butanamide Openeye Name: 4-(1,3-dioxoisoindolin-2-yl)-N-[3-(2-oxoazepan-1-yl)propyl]butanamide CAS Name: 4-(1,3-dioxo-2-isoindolyl)-N-[3-(2-oxo-1-azepanyl)propyl]butanamide IUPAC Name: 4-(1,3-dioxoisoindol-2-yl)-N-[3-(2-oxoazepan-1-yl)propyl]butanamide Traditional Name: N-[3-(2-ketoazepan-1-yl)propyl]-4-phthalimido-butyramide Formula: C21H27N3O4 MolecularWeight: 385.45678

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CCCNC(=O)CCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C1CCC(=O)N(CC1)CCCNC(=O)CCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H27N3O4/c25-18(22-12-7-14-23-13-5-1-2-11-19(23)26)10-6-15-24-20(27)16-8-3-4-9-17(16)21(24)28/h3-4,8-9H,1-2,5-7,10-15H2,(H,22,25)