1-[2-[4-(2-azanylethyl)phenoxy]ethyl]azepane-2,7-dione

Systemtic Name: 1-[2-[4-(2-azanylethyl)phenoxy]ethyl]azepane-2,7-dione Openeye Name: 1-[2-[4-(2-aminoethyl)phenoxy]ethyl]azepane-2,7-dione CAS Name: 1-[2-[4-(2-aminoethyl)phenoxy]ethyl]azepane-2,7-dione IUPAC Name: 1-[2-[4-(2-aminoethyl)phenoxy]ethyl]azepane-2,7-dione Traditional Name: 1-[2-[4-(2-aminoethyl)phenoxy]ethyl]azepane-2,7-quinone Formula: C16H22N2O3 MolecularWeight: 290.35748

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(C(=O)C1)CCOC2=CC=C(C=C2)CCN

Isomeric SMILES

C1CCC(=O)N(C(=O)C1)CCOC2=CC=C(C=C2)CCN

InChI

InChI=1S/C16H22N2O3/c17-10-9-13-5-7-14(8-6-13)21-12-11-18-15(19)3-1-2-4-16(18)20/h5-8H,1-4,9-12,17H2