[7-(1-nitronaphthalen-2-yl)heptanoylamino] hexanoate

Systemtic Name: [7-(1-nitronaphthalen-2-yl)heptanoylamino] hexanoate Openeye Name: [7-(1-nitro-2-naphthyl)heptanoylamino] hexanoate CAS Name: hexanoic acid [[7-(1-nitro-2-naphthalenyl)-1-oxoheptyl]amino] ester IUPAC Name: [7-(1-nitronaphthalen-2-yl)heptanoylamino] hexanoate Traditional Name: hexanoic acid [7-(1-nitro-2-naphthyl)heptanoylamino] ester Formula: C23H30N2O5 MolecularWeight: 414.4947

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)ONC(=O)CCCCCCC1=C(C2=CC=CC=C2C=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCCC(=O)ONC(=O)CCCCCCC1=C(C2=CC=CC=C2C=C1)[N+](=O)[O-]

InChI

InChI=1S/C23H30N2O5/c1-2-3-6-15-22(27)30-24-21(26)14-8-5-4-7-12-19-17-16-18-11-9-10-13-20(18)23(19)25(28)29/h9-11,13,16-17H,2-8,12,14-15H2,1H3,(H,24,26)