cyclooctadecane; (3-nitrophenyl) prop-2-enoate

Systemtic Name: cyclooctadecane; (3-nitrophenyl) prop-2-enoate Openeye Name: cyclooctadecane; (3-nitrophenyl) prop-2-enoate CAS Name: cyclooctadecane; 2-propenoic acid (3-nitrophenyl) ester IUPAC Name: cyclooctadecane; (3-nitrophenyl) prop-2-enoate Traditional Name: acrylic acid (3-nitrophenyl) ester; cyclooctadecane Formula: C27H43NO4 MolecularWeight: 445.63462

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)OC1=CC=CC(=C1)[N+](=O)[O-].C1CCCCCCCCCCCCCCCCC1

Isomeric SMILES

C=CC(=O)OC1=CC=CC(=C1)[N+](=O)[O-].C1CCCCCCCCCCCCCCCCC1

InChI

InChI=1S/C18H36.C9H7NO4/c1-2-4-6-8-10-12-14-16-18-17-15-13-11-9-7-5-3-1;1-2-9(11)14-8-5-3-4-7(6-8)10(12)13/h1-18H2;2-6H,1H2